Lonicera japonica
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Author: Public Domain - WikiMedia
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Table of Contents
Details Top
| Internal ID | UUID643ff4194756d107735325 |
| Scientific name | Lonicera japonica |
| Authority | Thunb. |
| First published in | Syst. Veg., ed. 14 (J. A. Murray). 216. 1784 [May-Jun 1784] |
Description Top
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The plant also contains the triterpenoid saponins loniceracetalides C and D. The plant also contains the triterpenoids lonicerol, lonicerone, and lonicerolide. The plant also contains the flavonoids luteolin and chrysin. The plant also contains the flavonoids luteolin 7-O-glucoside and luteolin 7-O-glucuronide. The plant also contains the flavonoid glycosides lonicerin and lonicerin-7-O-glucoside. The plant also contains the flavonoid glycosides loniceroside D and loniceroside E. The plant also contains the flavonoid glycosides loniceroside F and loniceroside G. The plant also contains the flavonoid glycosides loniceroside H and loniceroside I. The plant also contains the flavonoid glycosides loniceroside J and loniceroside K. The plant also contains the flavonoid glycosides loniceroside L and loniceroside M. The plant also contains the flavonoid glycosides loniceros
Synonyms Top
| Scientific name | Authority | First published in |
|---|---|---|
| Lonicera miyagusukiana | (Makino) Ohwi | Acta Phytotax. Geobot. 5: 179 (1936) |
| Lonicera aureoreticulata | hort. ex T.Moore | Florist & Pomol. 1862: 136 (1863) |
| Lonicera diversifolia | Carrière | Rev. Hort. (Paris) 37: 99 (1866) |
| Lonicera flexuosa | Thunb. | Trans. Linn. Soc. 2: 330 (1794) |
| Lonicera finlaysoniana | Wall. | Numer. List : n.º 6302 (1832) |
| Lonicera cochinchinensis | G.Don | Gen. Hist. 3: 447 (1834) |
| Lonicera repens | Hassk. | Cat. Hort. Bot. Bogor. Alt. : 116 (1844) |
| Nintooa japonica | Sweet | Hort. Brit. , ed. 2: 258 (1830) |
| Xylosteon flexuosum | (Thunb.) Dum.Cours. | Bot. Cult. , ed. 2, 7: 208 (1814) |
| Caprifolium brachypodum | Gordon | Garden (London, 1871-1927) 11: 88 (1877) |
| Caprifolium chinense | Wats. ex Loudon | Hort. Brit. [Loudon] 79. 1830 |
| Caprifolium japonicum | (Thunb.) Dum.Cours. | Bot. Cult. , ed. 2, 7: 209 (1814) |
| Caprifolium roseum | Lam. | Fl. Franç. 3: 368 (1779) |
| Lonicera brachypoda var. repens | Siebold | |
| Lonicera fauriei | H.Lév. & Vaniot | Repert. Spec. Nov. Regni Veg. 5: 100 (1908) |
| Lonicera chinensis | P.Watson | Dendrol. Brit. 2: t. 117 (1825) |
| Lonicera japonica var. repens | (Siebold) Rehder | J. Arnold Arbor. 7(1): 36–37 1926 |
| Lonicera brachypoda | DC. | Prodr. 4: 335 (1830) |
| Lonicera japonica f. macrantha | Matsuda | Bot. Mag. (Tokyo) 26(310): 307 1912 |
| Lonicera japonica var. sempervillosa | Hayata | Icon. Pl. Formosan. 9: 47 1920 |
| Lonicera shintenensis | Hayata | Icon. Pl. Formosan. 9: 48 (1920) |
Common names Top
Add a new one! Suggest a correction!| Language | Common/alternative name |
|---|---|
| English | golden-and-silver honeysuckle |
| English | japanese honeysuckle |
| Spanish | madreselva del japon |
| Spanish | madreselva |
| Spanish | madreselva del japón |
| Spanish | madreselva japonesa |
| Arabic | ياسمين عسل |
| Arabic | ياسمين عراقي |
| Arabic | ياسمين عراتلي |
| Arabic | زهر عسل |
| Arabic | ياسمين عرائلي |
| Arabic | عسلة يابانية |
| Azerbaijani | yapon doqquzdonu |
| azb | ژاپون دوققوزدونو |
| Bengali | মধুমতী |
| Catalan | xuclamel japonès |
| Welsh | gwyddfid japan |
| German | japanisches geißblatt |
| Esperanto | japana lonicero |
| Persian | لنیکرا جاپنیکا |
| French | chèvrefeuille du japon |
| Hebrew | יערה יפנית |
| Upper Sorbian | japanski kozylist |
| Hungarian | japán lonc |
| Indonesian | kamperfuli jepang |
| Indonesian | melati putri |
| Icelandic | tildurtoppur |
| Japanese | 忍冬 |
| Japanese | 金銀花 |
| Japanese | 吸葛 |
| Japanese | ニンドウ |
| Japanese | キンギンカ |
| Japanese | スイカズラ |
| Korean | 인동초 |
| Korean | 인동덩굴 |
| Korean | 인동 덩굴 |
| Korean | 금은화 |
| Korean | 금은등 |
| Korean | 겨우살이덩굴 |
| lzh | 忍冬 |
| Norwegian Bokmål | japankaprifol |
| Norwegian Nynorsk | japankaprifol |
| Swedish | slingertry |
| szy | nipaluma-kawayna |
| Thai | สายน้ำผึ้ง |
| Tonga | pua fisi |
| Vietnamese | kim ngân nhật |
| Vietnamese | nhẫn đông |
| Vietnamese | kim ngân |
| za | vagimngaenz |
| Chinese | 银藤 |
| Chinese | 忍冬藤 |
| Chinese | 鸳鸯藤 |
| Chinese | 金银花露 |
| Chinese | 金银藤 |
| Chinese | 金银花 |
| Chinese | 金銀花 |
| Chinese | 忍冬 |
| Chinese | 二宝藤 |
| Chinese | 二色花藤 |
| Chinese | 右转藤 |
| Chinese | 子风藤 |
| Chinese | 荵苳 |
| Chinese | 蜜桷藤 |
| Chinese | 老翁须 |
Varieties (abbr. var.) Top
Add a new one! Suggest a correction!| Name | Authority | First published in |
|---|---|---|
| Lonicera japonica var. chinensis | (P.Watson) Baker | Refug. Bot. 4: pl. 224 1871 |
Germination/Propagation Top
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No germination or propagation data was added yet.
Distribution (via POWO/KEW) Top
No distribution data was extracted from POWO/KEW yet. We are constantly monitoring for new data.
Links to other databases Top
Suggest others/fix!| Database | ID/link to page |
|---|---|
| World Flora Online | wfo-0000359579 |
| UNII | UV4X7MQQ43 |
| Florida Plant Atlas | 232 |
| Flora of Alabama | 1380 |
| Canadensys | 4218 |
| USDA Plants | LOJA |
| UConn | 262 |
| Tropicos | 6000048 |
| Tropicos | 50118144 |
| INPN | 106571 |
| Flora of Italy | 5154 |
| KEW | urn:lsid:ipni.org:names:148850-1 |
| The Plant List | kew-2339716 |
| PFAF | Lonicera japonica |
| PaleoBotany | 25658 |
| Open Tree Of Life | 2125 |
| Observations.org | 129674 |
| NCBI Taxonomy | 105884 |
| NBN Atlas | NHMSYS0000460450 |
| Nature Serve | 2.129271 |
| IPNI | 927299-1 |
| iNaturalist | 77835 |
| GBIF | 5334240 |
| Freebase | /m/02gjh8 |
| WisFlora | 4115 |
| FEIS | plants/vine/lonjap |
| EPPO | LONJA |
| EOL | 488681 |
| Elurikkus | 5538 |
| Calflora (Californian flora) | 5013 |
| USDA GRIN | 22588 |
| Wikipedia | Lonicera_japonica |
| CMAUP | NPO1515 |
Genomes (via NCBI) Top
Below is displayed the reference genome only!
If you wish to browse all genomes for this plant click here.
If you wish to browse all genomes for this plant click here.
| Accession | Assembly | |||||
|---|---|---|---|---|---|---|
| Name | Level | Submitter | Released | Coverage | Size | |
| GCA_021464415.1 | ASM2146441v1 | Chromosome | Guangxi University | 2022-01-19 | 98.9x | 845.08 Mb |
Scientific Literature Top
Below are displayed the latest 15 articles published in PMC (PubMed Central®) and other sources (DOI number only)!
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If you wish to see all the related articles click here.
Phytochemical Profile Top
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Below are displayed the proven (via scientific papers) natural compounds!
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| Name | PubChem ID | Canonical SMILES | MW | Found in | Proof |
|---|---|---|---|---|---|
| > Acetylides | |||||
| 1-Octadecyne | 69425 | Click to see CCCCCCCCCCCCCCCCC#C | 250.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| > Alkaloids and derivatives / Indolonaphthyridine alkaloids | |||||
| 12,13-Dimethoxy-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16),10,12,14-hexaen-2-one | 163038783 | Click to see COC1=C(C=C2C(=C1)C3=C4N2C(=O)CCC4=NC=C3)OC | 282.29 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| > Benzenoids / Benzene and substituted derivatives | |||||
| Benzaldehyde, oxime, (Z)- | 5324470 | Click to see C1=CC=C(C=C1)C=NO | 121.14 | unknown | via CMAUP database |
| Methyl phenylacetate | 7559 | Click to see COC(=O)CC1=CC=CC=C1 | 150.17 | unknown | https://doi.org/10.1021/JF950275B |
| Phenylethyl Alcohol | 6054 | Click to see C1=CC=C(C=C1)CCO | 122.16 | unknown | https://doi.org/10.1021/JF950275B |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters | |||||
| 1,2-Benzenedi(carboxylic-14C)acid, dibutyl ester | 171810 | Click to see CCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC | 282.33 | unknown | via CMAUP database |
| Benzyl Benzoate | 2345 | Click to see C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2 | 212.24 | unknown | https://doi.org/10.1021/JF950275B |
| Bis(2-methoxyethyl) phthalate | 8344 | Click to see COCCOC(=O)C1=CC=CC=C1C(=O)OCCOC | 282.29 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| Diisobutyl phthalate | 6782 | Click to see CC(C)COC(=O)C1=CC=CC=C1C(=O)OCC(C)C | 278.34 | unknown | via CMAUP database |
| Methyl benzoate | 7150 | Click to see COC(=O)C1=CC=CC=C1 | 136.15 | unknown | https://doi.org/10.1021/JF950275B |
| Phenethyl benzoate | 7194 | Click to see C1=CC=C(C=C1)CCOC(=O)C2=CC=CC=C2 | 226.27 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters / o-Hydroxybenzoic acid esters | |||||
| 2-Ethylhexyl salicylate | 8364 | Click to see CCCCC(CC)COC(=O)C1=CC=CC=C1O | 250.33 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| Methyl Salicylate | 4133 | Click to see COC(=O)C1=CC=CC=C1O | 152.15 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acids | |||||
| 2-(2-Ethylhexoxy)benzoate | 22074736 | Click to see CCCCC(CC)COC1=CC=CC=C1C(=O)[O-] | 249.32 | unknown | via CMAUP database |
| 2-Benzyloxybenzoic acid | 1810581 | Click to see C1=CC=C(C=C1)COC2=CC=CC=C2C(=O)O | 228.24 | unknown | https://doi.org/10.1021/JF950275B |
| 3-[(Z)-hex-1-enyl]benzoic acid | 67546487 | Click to see CCCCC=CC1=CC(=CC=C1)C(=O)O | 204.26 | unknown | https://doi.org/10.1021/JF950275B |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives | |||||
| 3,4-Dihydroxybenzoic acid | 72 | Click to see C1=CC(=C(C=C1C(=O)O)O)O | 154.12 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Gallic acids | |||||
| Gallic Acid | 370 | Click to see C1=C(C=C(C(=C1O)O)O)C(=O)O | 170.12 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives | |||||
| Vanillate | 54675858 | Click to see COC1=C(C=CC(=C1)C(=O)O)[O-] | 167.14 | unknown | via CMAUP database |
| Vanillic Acid | 8468 | Click to see COC1=C(C=CC(=C1)C(=O)O)O | 168.15 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / O-methoxybenzoic acids and derivatives | |||||
| 2-Methoxybenzoic acid | 11370 | Click to see COC1=CC=CC=C1C(=O)O | 152.15 | unknown | https://doi.org/10.1021/JF950275B |
| > Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives | |||||
| 2,4-Dimethylbenzaldehyde | 61814 | Click to see CC1=CC(=C(C=C1)C=O)C | 134.17 | unknown | via CMAUP database |
| 2,4,5-Trimethylbenzaldehyde | 22013 | Click to see CC1=CC(=C(C=C1C)C=O)C | 148.20 | unknown | via CMAUP database |
| Benzaldehyde | 240 | Click to see C1=CC=C(C=C1)C=O | 106.12 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzyl alcohols | |||||
| Benzyl Alcohol | 244 | Click to see C1=CC=C(C=C1)CO | 108.14 | unknown | https://doi.org/10.1021/JF950275B |
| phenylmethan(18O)ol | 11062333 | Click to see C1=CC=C(C=C1)CO | 110.14 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzyl cyanides | |||||
| Phenylacetonitrile | 8794 | Click to see C1=CC=C(C=C1)CC#N | 117.15 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzyloxycarbonyls | |||||
| Benzyl tiglate | 250096 | Click to see CC=C(C)C(=O)OCC1=CC=CC=C1 | 190.24 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| > Benzenoids / Benzene and substituted derivatives / Phenylacetaldehydes | |||||
| 1-deuterio-2-phenyl(113C)ethanone | 10441698 | Click to see C1=CC=C(C=C1)CC=O | 122.15 | unknown | via CMAUP database |
| Phenylacetaldehyde | 998 | Click to see C1=CC=C(C=C1)CC=O | 120.15 | unknown | https://doi.org/10.1021/JF950275B |
| > Benzenoids / Benzene and substituted derivatives / Phenylpropanes | |||||
| Butylated Hydroxytoluene | 31404 | Click to see CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C | 220.35 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Phenylpyruvic acid derivatives | |||||
| Loniphenyruviridoside B | 56598467 | Click to see C=CC1C2CC(OC(=O)C2=COC1OC3C(C(C(C(O3)CO)O)O)O)C(=C(C(=O)O)O)C4=CC=CC=C4 | 520.50 | unknown | https://doi.org/10.1021/NP2004566 |
| Loniphenyruviridoside C | 57398873 | Click to see C=CC1C2CC(OC(=O)C2=COC1OC3C(C(C(C(O3)CO)O)O)O)C(=C(C(=O)O)O)C4=CC=CC=C4 | 520.50 | unknown | https://doi.org/10.1021/NP2004566 |
| > Benzenoids / Benzene and substituted derivatives / Styrenes | |||||
| Pyridine, 2-(p-chlorostyryl)-4-((4-(diethylamino)-1-methylbutyl)amino)- | 5351244 | Click to see CCN(CC)CCCC(C)NC1=CC(=NC=C1)C=CC2=CC=C(C=C2)Cl | 371.90 | unknown | via CMAUP database |
| > Benzenoids / Phenols / Methoxyphenols | |||||
| [(Z)-(3-hydroxy-4-methoxyphenyl)methylideneamino]thiourea | 5395837 | Click to see COC1=C(C=C(C=C1)C=NNC(=S)N)O | 225.27 | unknown | via CMAUP database |
| 2-Allyl-6-methoxyphenol | 347577 | Click to see COC1=CC=CC(=C1O)CC=C | 164.20 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| 3-Hydroxy-4-Methoxybenzaldehyde Thiosemicarbazone | 6870649 | Click to see COC1=C(C=C(C=C1)C=NNC(=S)N)O | 225.27 | unknown | via CMAUP database |
| Eugenol | 3314 | Click to see COC1=C(C=CC(=C1)CC=C)O | 164.20 | unknown | https://doi.org/10.1021/JF950275B |
| Hydrazinecarbothioamide, 2-[(3-hydroxy-4-methoxyphenyl)methylene]- | 704492 | Click to see COC1=C(C=C(C=C1)C=NNC(=S)N)O | 225.27 | unknown | via CMAUP database |
| > Hydrocarbons / Saturated hydrocarbons | |||||
| Bicyclohexyl | 7094 | Click to see C1CCC(CC1)C2CCCCC2 | 166.30 | unknown | via CMAUP database |
| > Hydrocarbons / Saturated hydrocarbons / Alkanes | |||||
| Docosane | 12405 | Click to see CCCCCCCCCCCCCCCCCCCCCC | 310.60 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| Hentriacontane | 12410 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 436.80 | unknown | via CMAUP database |
| Heptacosane | 11636 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCC | 380.70 | unknown | via CMAUP database |
| Nonacosane | 12409 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCC | 408.80 | unknown | via CMAUP database |
| > Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons | |||||
| alpha-Myrcene | 519324 | Click to see CC(=C)CCCC(=C)C=C | 136.23 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| > Hydrocarbons / Unsaturated hydrocarbons / Unsaturated aliphatic hydrocarbons | |||||
| 1-Hexene | 11597 | Click to see CCCCC=C | 84.16 | unknown | https://doi.org/10.1021/JF950275B |
| > Lignans, neolignans and related compounds / Flavonolignans | |||||
| Hydnocarpin | 5489114 | Click to see COC1=C(C=CC(=C1)C2C(OC3=C(O2)C=CC(=C3)C4=CC(=O)C5=C(C=C(C=C5O4)O)O)CO)O | 464.40 | unknown | https://doi.org/10.3724/SP.J.1009.2010.00257 |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters | |||||
| (2-Pentadecyl-1,3-dioxolan-4-yl)methyl palmitate | 631084 | Click to see CCCCCCCCCCCCCCCC1OCC(O1)COC(=O)CCCCCCCCCCCCCCC | 552.90 | unknown | via CMAUP database |
| (E)-(Z)-Hex-3-en-1-yl 2-methylbut-2-enoate | 6435033 | Click to see CCC=CCCOC(=O)C(=CC)C | 182.26 | unknown | via CMAUP database |
| (Z,Z)-3-Hexenyl 2-methyl-2-butenoate | 49993 | Click to see CCC=CCCOC(=O)C(=CC)C | 182.26 | unknown | via CMAUP database |
| (Z)-3-Hexenyl Angelate | 16220109 | Click to see CCC=CCCOC(=O)C(=CC)C | 182.26 | unknown | via CMAUP database |
| Allyl stearate | 80500 | Click to see CCCCCCCCCCCCCCCCCC(=O)OCC=C | 324.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| cis-3-Hexenyl tiglate | 15461361 | Click to see CCC=CCCOC(=O)C(=CC)C | 182.26 | unknown | https://doi.org/10.1021/JF950275B |
| cis-Hexenyl tiglate | 129848383 | Click to see CCCCC=COC(=O)C(=CC)C | 182.26 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| Ethyl palmitate | 12366 | Click to see CCCCCCCCCCCCCCCC(=O)OCC | 284.50 | unknown | via CMAUP database |
| Hexyl tiglate | 637523 | Click to see CCCCCCOC(=O)C(=CC)C | 184.27 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| Isopropyl dodecanoate | 25068 | Click to see CCCCCCCCCCCC(=O)OC(C)C | 242.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| Stearic acid, (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester | 633404 | Click to see CCCCCCCCCCCCCCCCCC(=O)OCC1COC(O1)(C)C | 398.60 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Acyl carnitines | |||||
| Hexanoylcarnitine | 6426853 | Click to see CCCCCC(=O)OC(CC(=O)[O-])C[N+](C)(C)C | 259.34 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Fatty acid methyl esters | |||||
| 7-Hexadecenoic acid, methyl ester | 543305 | Click to see CCCCCCCCC=CCCCCCC(=O)OC | 268.40 | unknown | via CMAUP database |
| cis-7-Hexadecenoic Acid methyl ester | 14029831 | Click to see CCCCCCCCC=CCCCCCC(=O)OC | 268.40 | unknown | via CMAUP database |
| formyl 7E-hexadecenoate | 5364431 | Click to see CCCCCCCCC=CCCCCCC(=O)OC | 268.40 | unknown | via CMAUP database |
| methyl (114C)hexadecanoate | 10378565 | Click to see CCCCCCCCCCCCCCCC(=O)OC | 272.44 | unknown | via CMAUP database |
| Methyl 15-methylhexadecanoate | 522345 | Click to see CC(C)CCCCCCCCCCCCCC(=O)OC | 284.50 | unknown | via CMAUP database |
| Methyl arachidate | 14259 | Click to see CCCCCCCCCCCCCCCCCCCC(=O)OC | 326.60 | unknown | via CMAUP database |
| Methyl behenate | 13584 | Click to see CCCCCCCCCCCCCCCCCCCCCC(=O)OC | 354.60 | unknown | via CMAUP database |
| Methyl palmitate | 8181 | Click to see CCCCCCCCCCCCCCCC(=O)OC | 270.50 | unknown | https://doi.org/10.1021/JF950275B |
| Methyl Pentadecanoate | 23518 | Click to see CCCCCCCCCCCCCCC(=O)OC | 256.42 | unknown | via CMAUP database |
| Methyl Stearate | 8201 | Click to see CCCCCCCCCCCCCCCCCC(=O)OC | 298.50 | unknown | via CMAUP database |
| Methyl tetracosanoate | 75546 | Click to see CCCCCCCCCCCCCCCCCCCCCCCC(=O)OC | 382.70 | unknown | via CMAUP database |
| Methyl Tetradecanoate | 31284 | Click to see CCCCCCCCCCCCCC(=O)OC | 242.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Branched fatty acids / Methyl-branched fatty acids | |||||
| 2-(111C)methylbutanoic acid | 450639 | Click to see CCC(C)C(=O)O | 101.13 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids | |||||
| (E)-11-Hexadecenoic acid | 5312413 | Click to see CCCCC=CCCCCCCCCCC(=O)O | 254.41 | unknown | via CMAUP database |
| (Z)-11-hexadecenoic acid | 5312414 | Click to see CCCCC=CCCCCCCCCCC(=O)O | 254.41 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| CID 543388 | 543388 | Click to see CCCCC=CCCCCCCCCCC(=O)O | 254.41 | unknown | via CMAUP database |
| Heptadecanoic acid | 10465 | Click to see CCCCCCCCCCCCCCCCC(=O)O | 270.50 | unknown | via CMAUP database |
| Myristic Acid | 11005 | Click to see CCCCCCCCCCCCCC(=O)O | 228.37 | unknown | via CMAUP database |
| Palmitic Acid | 985 | Click to see CCCCCCCCCCCCCCCC(=O)O | 256.42 | unknown | via CMAUP database |
| Pentadecanoic Acid | 13849 | Click to see CCCCCCCCCCCCCCC(=O)O | 242.40 | unknown | via CMAUP database |
| trans-13-Octadecenoic acid | 6161490 | Click to see CCCCC=CCCCCCCCCCCCC(=O)O | 282.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids | |||||
| Capric Acid | 2969 | Click to see CCCCCCCCCC(=O)O | 172.26 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| Lauric Acid | 3893 | Click to see CCCCCCCCCCCC(=O)O | 200.32 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Straight chain fatty acids | |||||
| Valeric acid | 7991 | Click to see CCCCC(=O)O | 102.13 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters | |||||
| (Z)-Nerolidol acetate | 6430791 | Click to see CC(=CCCC=CCCC(C)(C=C)OC(=O)C)C | 250.38 | unknown | via CMAUP database |
| 6-Octen-1-ol, 3,7-dimethyl-, acetate, (3S)- | 6999975 | Click to see CC(CCC=C(C)C)CCOC(=O)C | 198.30 | unknown | via CMAUP database |
| Octyl Acetate | 8164 | Click to see CCCCCCCCOC(=O)C | 172.26 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols | |||||
| (2R)-2-butyloctan-1-ol | 76960266 | Click to see CCCCCCC(CCCC)CO | 186.33 | unknown | via CMAUP database |
| 1-Hexanol | 8103 | Click to see CCCCCCO | 102.17 | unknown | via CMAUP database |
| 2-Ethylhexan-1-ol | 7720 | Click to see CCCCC(CC)CO | 130.23 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| cis-3-Hexen-1-ol | 5281167 | Click to see CCC=CCCO | 100.16 | unknown | https://doi.org/10.1021/JF950275B |
| trans-3-Hexen-1-ol | 5284503 | Click to see CCC=CCCO | 100.16 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Long-chain fatty alcohols | |||||
| 1-Eicosanol | 12404 | Click to see CCCCCCCCCCCCCCCCCCCCO | 298.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| methyl (S)-3-hydroxypalmitate | 12201888 | Click to see CCCCCCCCCCCCCC(CC(=O)OC)O | 286.40 | unknown | via CMAUP database |
| Methyl 3-hydroxyhexadecanoate | 103553 | Click to see CCCCCCCCCCCCCC(CC(=O)OC)O | 286.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty aldehydes | |||||
| Hexadecanal | 984 | Click to see CCCCCCCCCCCCCCCC=O | 240.42 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives | |||||
| 9,12,15-Octadecatrienoic acid ethyl ester | 6371716 | Click to see CCC=CCC=CCC=CCCCCCCCC(=O)OCC | 306.50 | unknown | via CMAUP database |
| Linoleic Acid | 5280450 | Click to see CCCCCC=CCC=CCCCCCCCC(=O)O | 280.40 | unknown | via CMAUP database |
| Linolenic Acid | 5280934 | Click to see CCC=CCC=CCC=CCCCCCCCC(=O)O | 278.40 | unknown | via CMAUP database |
| methyl (9E,13E)-octadeca-9,13-dienoate | 5319705 | Click to see CCCCC=CCCC=CCCCCCCCC(=O)OC | 294.50 | unknown | via CMAUP database |
| Methyl linolelaidate | 5362793 | Click to see CCCCCC=CCC=CCCCCCCCC(=O)OC | 294.50 | unknown | via CMAUP database |
| Methyl linolenate | 5319706 | Click to see CCC=CCC=CCC=CCCCCCCCC(=O)OC | 292.50 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids | |||||
| Isophytol | 10453 | Click to see CC(C)CCCC(C)CCCC(C)CCCC(C)(C=C)O | 296.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids | |||||
| beta-CITRONELLOL, (+/-)- | 8842 | Click to see CC(CCC=C(C)C)CCO | 156.26 | unknown | https://doi.org/10.1021/JF950275B |
| beta-CITRONELLOL, (R)- | 101977 | Click to see CC(CCC=C(C)C)CCO | 156.26 | unknown | via CMAUP database |
| Geraniol | 637566 | Click to see CC(=CCCC(=CCO)C)C | 154.25 | unknown | https://doi.org/10.1021/JF950275B |
| Geranylacetone | 1549778 | Click to see CC(=CCCC(=CCCC(=O)C)C)C | 194.31 | unknown |
https://doi.org/10.1021/JF950275B https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| Linalool, (-)- | 443158 | Click to see CC(=CCCC(C)(C=C)O)C | 154.25 | unknown | via CMAUP database |
| Linalool, (+)- | 67179 | Click to see CC(=CCCC(C)(C=C)O)C | 154.25 | unknown | via CMAUP database |
| Linalool, (+/-)- | 6549 | Click to see CC(=CCCC(C)(C=C)O)C | 154.25 | unknown | via CMAUP database |
| Nerol | 643820 | Click to see CC(=CCCC(=CCO)C)C | 154.25 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids | |||||
| Carvacrol | 10364 | Click to see CC1=C(C=C(C=C1)C(C)C)O | 150.22 | unknown | https://doi.org/10.1021/JF950275B |
| Carvacryl acetate | 80792 | Click to see CC1=C(C=C(C=C1)C(C)C)OC(=O)C | 192.25 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids | |||||
| (-)-alpha-Pinene | 440968 | Click to see CC1=CCC2CC1C2(C)C | 136.23 | unknown | via CMAUP database |
| (-)-Pinene | 15837102 | Click to see CC1=C2CC(C2(C)C)CC1 | 136.23 | unknown | https://doi.org/10.1021/JF950275B |
| beta-Pinene | 14896 | Click to see CC1(C2CCC(=C)C1C2)C | 136.23 | unknown | via CMAUP database |
| Bornyl acetate | 6448 | Click to see CC(=O)OC1CC2CCC1(C2(C)C)C | 196.29 | unknown | via CMAUP database |
| Bornyl acetate, (-)- | 93009 | Click to see CC(=O)OC1CC2CCC1(C2(C)C)C | 196.29 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids | |||||
| (-)-alpha-Terpineol | 443162 | Click to see CC1=CCC(CC1)C(C)(C)O | 154.25 | unknown | via CMAUP database |
| (-)-Terpinen-4-ol | 5325830 | Click to see CC1=CCC(CC1)(C(C)C)O | 154.25 | unknown | via CMAUP database |
| (+)-alpha-Terpineol | 442501 | Click to see CC1=CCC(CC1)C(C)(C)O | 154.25 | unknown | via CMAUP database |
| 4-Terpineol, (+/-)- | 11230 | Click to see CC1=CCC(CC1)(C(C)C)O | 154.25 | unknown | via CMAUP database |
| Alpha-Terpineol | 17100 | Click to see CC1=CCC(CC1)C(C)(C)O | 154.25 | unknown | https://doi.org/10.1021/JF950275B |
| Delta-Terpineol | 81722 | Click to see CC(C)(C1CCC(=C)CC1)O | 154.25 | unknown | via CMAUP database |
| L-Menthyl acetate | 220674 | Click to see CC1CCC(C(C1)OC(=O)C)C(C)C | 198.30 | unknown | via CMAUP database |
| p-Mentha-1,5-dien-8-ol | 519323 | Click to see CC1=CCC(C=C1)C(C)(C)O | 152.23 | unknown | via CMAUP database |
| Piperitenone | 381152 | Click to see CC1=CC(=O)C(=C(C)C)CC1 | 150.22 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| > Lipids and lipid-like molecules / Prenol lipids / Quinone and hydroquinone lipids / Vitamin E compounds / Tocopherols | |||||
| Delta-Tocopherol | 92094 | Click to see CC1=CC(=CC2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)O | 402.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids | |||||
| (-)-alpha-Curcumene | 442360 | Click to see CC1=CC=C(C=C1)C(C)CCC=C(C)C | 202.33 | unknown | via CMAUP database |
| (+)-Nerolidol | 5356544 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
| (2E,6E)-3,7,11-trimethyl-10-tritiododeca-2,6,10-trienal | 10537023 | Click to see CC(=CCCC(=CCCC(=CC=O)C)C)C | 222.36 | unknown | via CMAUP database |
| (3R,6E)-nerolidol | 11241545 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
| (3S,6E)-Nerolidol | 5281525 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
| (E,Z)-farnesol | 1549109 | Click to see CC(=CCCC(=CCCC(=CCO)C)C)C | 222.37 | unknown | via CMAUP database |
| (E)-beta-farnesene | 10407 | Click to see CC(=CCCC(=CCCC(=C)C=C)C)C | 204.35 | unknown | via CMAUP database |
| (Z)-3,7,11-trimethyldodec-6-en-1-ol | 42626572 | Click to see CC(C)CCCC(=CCCC(C)CCO)C | 226.40 | unknown | via CMAUP database |
| 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, (3R,6Z)- | 12227246 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
| 3,7,11-Trimethyl-2,6,10-dodecatrienyl acetate | 638500 | Click to see CC(=CCCC(=CCCC(=CCOC(=O)C)C)C)C | 264.40 | unknown | via CMAUP database |
| 4,11,11-Trimethyl-8-methylene-5-oxatricyclo(8.2.0.0(4,6))dodecane, (1R,4R,6R,10S)- | 6604672 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | via CMAUP database |
| alpha-Bisabolol | 10586 | Click to see CC1=CCC(CC1)C(C)(CCC=C(C)C)O | 222.37 | unknown | via CMAUP database |
| alpha-Curcumene | 92139 | Click to see CC1=CC=C(C=C1)C(C)CCC=C(C)C | 202.33 | unknown | via CMAUP database |
| Alpha-Farnesene | 5281516 | Click to see CC(=CCCC(=CCC=C(C)C=C)C)C | 204.35 | unknown | https://doi.org/10.1021/JF950275B |
| alpha-Ionol | 5363817 | Click to see CC1=CCCC(C1C=CC(C)O)(C)C | 194.31 | unknown | via CMAUP database |
| beta-Bourbonene | 62566 | Click to see CC(C)C1CCC2(C1C3C2CCC3=C)C | 204.35 | unknown | https://doi.org/10.1021/JF950275B |
| beta-CARYOPHYLLENE OXIDE | 1742210 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | via CMAUP database |
| beta-Farnesene | 5281517 | Click to see CC(=CCCC(=CCCC(=C)C=C)C)C | 204.35 | unknown | via CMAUP database |
| beta-Farnesene, (6Z)- | 5317319 | Click to see CC(=CCCC(=CCCC(=C)C=C)C)C | 204.35 | unknown | via CMAUP database |
| beta-Ionone | 638014 | Click to see CC1=C(C(CCC1)(C)C)C=CC(=O)C | 192.30 | unknown | via CMAUP database |
| Bisabolol | 1549992 | Click to see CC1=CCC(CC1)C(C)(CCC=C(C)C)O | 222.37 | unknown | via CMAUP database |
| Caryophyllene | 5281515 | Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C | 204.35 | unknown | https://doi.org/10.1021/JF950275B |
| Caryophyllene epoxide | 14350 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | via CMAUP database |
| Caryophyllene oxide 2 | 13240188 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | via CMAUP database |
| CID 98043 | 98043 | Click to see CC(=CCCC(=CCCC(C)(C=C)OC(=O)C)C)C | 264.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| cis-Nerolidol | 5320128 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
| cis,cis-Farnesol | 1549107 | Click to see CC(=CCCC(=CCCC(=CCO)C)C)C | 222.37 | unknown | via CMAUP database |
| Farnesal | 5280598 | Click to see CC(=CCCC(=CCCC(=CC=O)C)C)C | 220.35 | unknown | via CMAUP database |
| Farnesol | 3327 | Click to see CC(=CCCC(=CCCC(=CCO)C)C)C | 222.37 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| Isocaryophyllene oxide | 1742211 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| Levomenol | 442343 | Click to see CC1=CCC(CC1)C(C)(CCC=C(C)C)O | 222.37 | unknown | via CMAUP database |
| Nerolidol | 8888 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | https://doi.org/10.1021/JF950275B |
| Nerolidyl acetate | 5363426 | Click to see CC(=CCCC(=CCCC(C)(C=C)OC(=O)C)C)C | 264.40 | unknown | via CMAUP database |
| trans-Nerolidol | 5284507 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
| trans,trans-Farnesol | 445070 | Click to see CC(=CCCC(=CCCC(=CCO)C)C)C | 222.37 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Abscisic acids and derivatives | |||||
| (-)-Abscisic acid | 643732 | Click to see CC1=CC(=O)CC(C1(C=CC(=CC(=O)O)C)O)(C)C | 264.32 | unknown | via CMAUP database |
| (+)-Abscisic acid | 5375200 | Click to see CC1=CC(=O)CC(C1(C=CC(=CC(=O)O)C)O)(C)C | 264.32 | unknown | via CMAUP database |
| 5-(1-Hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)-3-methylpenta-2,4-dienoic acid | 287291 | Click to see CC1=CC(=O)CC(C1(C=CC(=CC(=O)O)C)O)(C)C | 264.32 | unknown | via CMAUP database |
| Abscisic acid | 5280896 | Click to see CC1=CC(=O)CC(C1(C=CC(=CC(=O)O)C)O)(C)C | 264.32 | unknown | via CMAUP database |
| Dormin | 5375199 | Click to see CC1=CC(=O)CC(C1(C=CC(=CC(=O)O)C)O)(C)C | 264.32 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids | |||||
| (-)-Ledol | 6431133 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O | 222.37 | unknown | via CMAUP database |
| (+)-Aromadendrene | 11095734 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C | 204.35 | unknown | via CMAUP database |
| (+)-Ledol | 11074994 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O | 222.37 | unknown | via CMAUP database |
| (1aS,4aS,7aS,7bR)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene | 91746456 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C | 204.35 | unknown | via CMAUP database |
| 1H-Cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-tetramethyl-, [1ar-(1aalpha,4alpha,4abeta,7alpha,7abeta,7balpha)]- | 6432561 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O | 222.37 | unknown | via CMAUP database |
| Aromadendrene | 91354 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C | 204.35 | unknown | via CMAUP database |
| beta-Diploalbicene | 177445 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C | 204.35 | unknown | via CMAUP database |
| Globulol | 101716 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O | 222.37 | unknown | via CMAUP database |
| Ledol | 92812 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O | 222.37 | unknown | via CMAUP database |
| Ledum camphor | 22297324 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2(C)O | 222.37 | unknown | via CMAUP database |
| Macrocarpal A | 454457 | Click to see CC(C)CC(C1=C(C(=C(C(=C1O)C=O)O)C=O)O)C2(CCC3C2C4C(C4(C)C)CCC3(C)O)C | 472.60 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Cedrane and isocedrane sesquiterpenoids | |||||
| (5S,7S,8R)-6,6,8-Trimethyl-2-methylidenetricyclo[5.3.1.01,5]undecane | 12302594 | Click to see CC1CCC2C13CC=C(C(C3)C2(C)C)C | 204.35 | unknown | via CMAUP database |
| alpha-Cedrene | 6431015 | Click to see CC1CCC2C13CC=C(C(C3)C2(C)C)C | 204.35 | unknown | via CMAUP database |
| Cedr-8(15)-ene | 102432 | Click to see CC1CCC2C13CCC(=C)C(C3)C2(C)C | 204.35 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| Cedrene | 521207 | Click to see CC1CCC2C13CC=C(C(C3)C2(C)C)C | 204.35 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Germacrane sesquiterpenoids | |||||
| (+)-Germacrene D | 24771782 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| (1E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene | 74764030 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| (1Z,6Z)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene | 5373727 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| (1Z)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene | 92003564 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| (6E,8S)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene | 49796490 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| 1-Methyl-5-methylene-8-(1-methylethyl)-1,6-cyclodecadiene | 6436582 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| Germacrene D | 5317570 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides | |||||
| (2R)-2-[3-[(E)-2-[(2S,3R,4S)-5-carboxy-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]ethenyl]pyridin-1-ium-1-yl]-3-phenylpropanoate | 76309955 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)C=CC3=C[N+](=CC=C3)C(CC4=CC=CC=C4)C(=O)[O-] | 583.60 | unknown | via CMAUP database |
| (2R)-2-[3-carboxy-5-[(E)-2-[(2S,3R,4S)-5-carboxy-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]ethenyl]pyridin-1-ium-1-yl]-3-phenylpropanoate | 76324558 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)C=CC3=CC(=C[N+](=C3)C(CC4=CC=CC=C4)C(=O)[O-])C(=O)O | 627.60 | unknown | via CMAUP database |
| (2S,3R,4S)-3-ethenyl-4-(2-methoxy-2-oxoethyl)-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylic acid | 11729149 | Click to see COC(=O)CC1C(C(OC=C1C(=O)O)OC2C(C(C(C(O2)CO)O)O)O)C=C | 404.40 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| (2S,3R,4S)-4-(carboxymethyl)-3-ethenyl-2-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylic acid | 162970626 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)CC(=O)O | 390.34 | unknown | https://doi.org/10.1021/NP800040K |
| (2S,3R,4S)-4-[(E)-2-[5-carboxy-1-[(1S,2S)-1-carboxy-2-methylbutyl]pyridin-1-ium-3-yl]ethenyl]-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate | 76317186 | Click to see CCC(C)C(C(=O)O)[N+]1=CC(=CC(=C1)C(=O)O)C=CC2C(C(OC=C2C(=O)[O-])OC3C(C(C(C(O3)CO)O)O)O)C=C | 593.60 | unknown | via CMAUP database |
| (2S,3R,4S)-4-[(E)-2-[5-carboxy-1-[(1S)-1-carboxy-3-methylbutyl]pyridin-1-ium-3-yl]ethenyl]-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate | 76309957 | Click to see CC(C)CC(C(=O)O)[N+]1=CC(=CC(=C1)C(=O)O)C=CC2C(C(OC=C2C(=O)[O-])OC3C(C(C(C(O3)CO)O)O)O)C=C | 593.60 | unknown | via CMAUP database |
| (2S,3R,4S)-4-[(Z)-2-[1-[(1R)-1-carboxy-2-phenylethyl]pyridin-1-ium-3-yl]ethenyl]-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate | 76328126 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)[O-])C=CC3=C[N+](=CC=C3)C(CC4=CC=CC=C4)C(=O)O | 583.60 | unknown | via CMAUP database |
| (2S)-2-[2-[(2S,3R,4S)-3-ethenyl-5-methoxycarbonyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]ethylamino]-3-phenylpropanoic acid | 101189142 | Click to see COC(=O)C1=COC(C(C1CCNC(CC2=CC=CC=C2)C(=O)O)C=C)OC3C(C(C(C(O3)CO)O)O)O | 537.60 | unknown | https://doi.org/10.1248/CPB.50.1041 |
| (2S)-2-[3-[(E)-2-[(2S,3R,4S)-3-ethenyl-5-methoxycarbonyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]ethenyl]pyridin-1-ium-1-yl]propanoate | 76335389 | Click to see CC(C(=O)[O-])[N+]1=CC=CC(=C1)C=CC2C(C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)C=C | 521.50 | unknown | via CMAUP database |
| (2S)-2-[3-[(E)-2-[(2S,3R,4S)-5-carbamoyl-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]ethenyl]pyridin-1-ium-1-yl]-5-hydroxy-5-oxopentanoate | 76328124 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)N)C=CC3=C[N+](=CC=C3)C(CCC(=O)O)C(=O)[O-] | 564.50 | unknown | via CMAUP database |
| (2S)-2-[3-[(E)-2-[(2S,3R,4S)-5-carboxy-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]ethenyl]pyridin-1-ium-1-yl]propanoate | 76335387 | Click to see CC(C(=O)[O-])[N+]1=CC=CC(=C1)C=CC2C(C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)C=C | 507.50 | unknown | via CMAUP database |
| (2S)-2-[3-carboxy-5-[(E)-2-[(2S,3R,4S)-3-ethenyl-5-methoxycarbonyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]ethenyl]pyridin-1-ium-1-yl]-3-methylbutanoate | 76328128 | Click to see CC(C)C(C(=O)[O-])[N+]1=CC(=CC(=C1)C(=O)O)C=CC2C(C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)C=C | 593.60 | unknown | via CMAUP database |
| (6S)-4beta-[2-[5-(Butoxycarbonyl)-3-pyridyl]ethenyl]-5beta-ethenyl-6alpha-(beta-D-glucopyranosyloxy)-5,6-dihydro-4H-pyran-3-carboxylic acid methyl ester | 102193289 | Click to see CCCCOC(=O)C1=CN=CC(=C1)C=CC2C(C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)C=C | 549.60 | unknown | via CMAUP database |
| (6S)-4beta-[2-[5-(Methoxycarbonyl)-3-pyridyl]ethenyl]-5beta-ethenyl-6alpha-(beta-D-glucopyranosyloxy)-5,6-dihydro-4H-pyran-3-carboxylic acid methyl ester | 101792584 | Click to see COC(=O)C1=CN=CC(=C1)C=CC2C(C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)C=C | 507.50 | unknown | via CMAUP database |
| (E)-Aldosecologanin | 10908841 | Click to see COC(=O)C1=COC(C(C1CC=C(C=O)C2C(C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)C=C)C=C)OC4C(C(C(C(O4)CO)O)O)O | 758.70 | unknown | via CMAUP database |
| (E)-Aldosecologanin | 45783101 | Click to see COC(=O)C1=COC(C(C1CC=C(C=O)C2C(C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)C=C)C=C)OC4C(C(C(C(O4)CO)O)O)O | 758.70 | unknown | https://doi.org/10.1248/CPB.50.1041 |
| 2-[(2S)-3-ethenyl-5-methoxycarbonyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]acetic acid | 9978537 | Click to see COC(=O)C1=COC(C(C1CC(=O)O)C=C)OC2C(C(C(C(O2)CO)O)O)O | 404.40 | unknown | via CMAUP database |
| 2-[2-[3-ethenyl-5-methoxycarbonyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]ethylamino]-3-phenylpropanoic acid | 85359951 | Click to see COC(=O)C1=COC(C(C1CCNC(CC2=CC=CC=C2)C(=O)O)C=C)OC3C(C(C(C(O3)CO)O)O)O | 537.60 | unknown | https://doi.org/10.1248/CPB.50.1041 |
| 2-[3-ethenyl-5-methoxycarbonyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]acetic acid | 14105068 | Click to see COC(=O)C1=COC(C(C1CC(=O)O)C=C)OC2C(C(C(C(O2)CO)O)O)O | 404.40 | unknown |
https://doi.org/10.1248/BPB.34.1330 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6274294/ https://doi.org/10.1021/NP800040K https://doi.org/10.1016/J.FOODCHEM.2012.10.127 |
| 3-ethenyl-4-(2-methoxy-2-oxoethyl)-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylic acid | 73076227 | Click to see COC(=O)CC1C(C(OC=C1C(=O)O)OC2C(C(C(C(O2)CO)O)O)O)C=C | 404.40 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| 5-[(E)-2-[(2S,3R,4S)-5-carboxy-3-ethenyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]ethenyl]-1-(2-hydroxyethyl)pyridin-1-ium-3-carboxylate | 24879106 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)C=CC3=CC(=C[N+](=C3)CCO)C(=O)[O-] | 523.50 | unknown | via CMAUP database |
| CID 24879107 | 24879107 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)C=CC3=CC(=C[N+](=C3)CCO)C(=O)O | 524.50 | unknown | https://doi.org/10.1021/NP800040K |
| CID 24879109 | 24879109 | Click to see COC(=O)C1=COC(C(C1C=CC2=CC(=C[N+](=C2)CCCC(=O)O)C(=O)O)C=C)OC3C(C(C(C(O3)CO)O)O)O | 580.60 | unknown | https://doi.org/10.1021/NP800040K |
| CID 24879111 | 24879111 | Click to see COC(=O)C1=COC(C(C1C=CC2=CC(=C[N+](=C2)CCO)C(=O)O)C=C)OC3C(C(C(C(O3)CO)O)O)O | 538.50 | unknown | https://doi.org/10.1021/NP800040K |
| Loniceracetalide A | 637857 | Click to see CC1C(OC(O1)CC2C(C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)C=C)C | 460.50 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| Lonijaposide A | 24879108 | Click to see COC(=O)C1=COC(C(C1C=CC2=CC(=C[N+](=C2)CCCC(=O)O)C(=O)[O-])C=C)OC3C(C(C(C(O3)CO)O)O)O | 579.50 | unknown | via CMAUP database |
| Lonijaposide B | 24879110 | Click to see COC(=O)C1=COC(C(C1C=CC2=CC(=C[N+](=C2)CCO)C(=O)[O-])C=C)OC3C(C(C(C(O3)CO)O)O)O | 537.50 | unknown | via CMAUP database |
| Lonijaposide D | 56599664 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)C=CC3=CC(=C[N+](=C3)CCCC(=O)O)C(=O)[O-] | 565.50 | unknown | https://doi.org/10.1021/NP2004566 |
| Lonijaposide E | 56599666 | Click to see CC[N+]1=CC(=CC(=C1)C(=O)[O-])C=CC2C(C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)C=C | 521.50 | unknown | https://doi.org/10.1021/NP2004566 |
| Lonijaposide F | 56599668 | Click to see CC[N+]1=CC(=CC(=C1)C(=O)[O-])C=CC2C(C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)C=C | 507.50 | unknown | https://doi.org/10.1021/NP2004566 |
| Lonijaposide G | 56599669 | Click to see C[N+]1=CC(=CC(=C1)C(=O)[O-])C=CC2C(C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)C=C | 507.50 | unknown | https://doi.org/10.1021/NP2004566 |
| Lonijaposide I | 56598336 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)[O-])C=CC3=C[N+](=CC=C3)CCO | 479.50 | unknown | https://doi.org/10.1021/NP2004566 |
| Lonijaposide K | 56599871 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)[O-])C=CC3=C[N+](=CC=C3)CC(=O)O | 493.50 | unknown | https://doi.org/10.1021/NP2004566 |
| Lonijaposide L | 56599872 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)[O-])C=CC3=C[N+](=CC=C3)CCC(=O)O | 507.50 | unknown | https://doi.org/10.1021/NP2004566 |
| Lonijaposide M | 56599874 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)[O-])C=CC3=C[N+](=CC=C3)CCCC(=O)O | 521.50 | unknown | https://doi.org/10.1021/NP2004566 |
| Lonijaposide N | 56600069 | Click to see COC(=O)C1=COC(C(C1C=CC2=C[N+](=CC=C2)CCCC(=O)[O-])C=C)OC3C(C(C(C(O3)CO)O)O)O | 535.50 | unknown | https://doi.org/10.1021/NP2004566 |
| Loniphenyruviridoside D | 56598469 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)CC3C(=C(C(=O)O3)O)C4=CC=CC=C4 | 520.50 | unknown | https://doi.org/10.1021/NP2004566 |
| methyl (2R,3R,4S)-3-ethenyl-4-(2-oxoethyl)-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate | 124351303 | Click to see COC(=O)C1=COC(C(C1CC=O)C=C)OC2C(C(C(C(O2)CO)O)O)O | 388.40 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| methyl (2S,3R,4S)-3-ethenyl-4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-3-yl]ethenyl]-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate | 56599870 | Click to see COC(=O)C1=COC(C(C1C=CC2=C[N+](=CC=C2)CCO)C=C)OC3C(C(C(C(O3)CO)O)O)O | 494.50 | unknown | https://doi.org/10.1021/NP2004566 |
| methyl (2S,3R,4S)-3-ethenyl-4-[(Z)-3-[(2S,3R,4S)-3-ethenyl-5-methoxycarbonyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]-4-oxobut-2-enyl]-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate | 102183195 | Click to see COC(=O)C1=COC(C(C1CC=C(C=O)C2C(C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)C=C)C=C)OC4C(C(C(C(O4)CO)O)O)O | 758.70 | unknown | via CMAUP database |
| Methyl 2-(hexopyranosyloxy)-4-(2-oxoethyl)-3-vinyl-3,4-dihydro-2H-pyran-5-carboxylate | 369002 | Click to see COC(=O)C1=COC(C(C1CC=O)C=C)OC2C(C(C(C(O2)CO)O)O)O | 388.40 | unknown |
https://doi.org/10.1016/S0031-9422(00)00279-X https://doi.org/10.1021/NP800040K |
| methyl 3-ethenyl-4-[3-[3-ethenyl-5-methoxycarbonyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]-4-oxobut-2-enyl]-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate | 75130896 | Click to see COC(=O)C1=COC(C(C1CC=C(C=O)C2C(C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)C=C)C=C)OC4C(C(C(C(O4)CO)O)O)O | 758.70 | unknown | https://doi.org/10.1248/CPB.50.1041 |
| methyl 4-(2,2-dimethoxyethyl)-3-ethenyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate | 14192587 | Click to see COC(CC1C(C(OC=C1C(=O)OC)OC2C(C(C(C(O2)CO)O)O)O)C=C)OC | 434.40 | unknown |
https://doi.org/10.1016/S0031-9422(00)00279-X https://doi.org/10.1248/CPB.36.3664 |
| methyl 4-[(4,5-dimethyl-1,3-dioxolan-2-yl)methyl]-3-ethenyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate | 20979951 | Click to see CC1C(OC(O1)CC2C(C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)C=C)C | 460.50 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| Secologanate | 439612 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)CC=O | 374.34 | unknown | via CMAUP database |
| Secologanin | 161276 | Click to see COC(=O)C1=COC(C(C1CC=O)C=C)OC2C(C(C(C(O2)CO)O)O)O | 388.40 | unknown |
https://doi.org/10.1016/S0031-9422(00)00279-X https://doi.org/10.1016/S0031-9422(02)00057-2 https://doi.org/10.1021/NP800040K https://doi.org/10.1016/S0031-9422(99)00471-9 https://doi.org/10.1039/P19830001949 https://doi.org/10.1021/NP50125A020 |
| Secologanin dimethyl acetal | 157140 | Click to see COC(CC1C(C(OC=C1C(=O)OC)OC2C(C(C(C(O2)CO)O)O)O)C=C)OC | 434.40 | unknown |
https://doi.org/10.1016/S0031-9422(00)00279-X https://doi.org/10.1248/CPB.36.3664 |
| Secologanoside | 14136854 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)CC(=O)O | 390.34 | unknown | https://doi.org/10.1021/NP800040K |
| Secologanoside 7-methyl ester | 14136853 | Click to see C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)CC(=O)O | 390.34 | unknown | https://doi.org/10.1021/NP800040K |
| Secoxyloganin | 162868 | Click to see COC(=O)C1=COC(C(C1CC(=O)O)C=C)OC2C(C(C(C(O2)CO)O)O)O | 404.40 | unknown |
https://doi.org/10.1021/NP50056A022 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4014484/ https://doi.org/10.1016/J.FOODCHEM.2012.10.127 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6274294/ https://doi.org/10.1248/BPB.34.1330 https://doi.org/10.1021/NP800040K |
| Secoxyloganin methyl ester | 14105070 | Click to see COC(=O)CC1C(C(OC=C1C(=O)OC)OC2C(C(C(C(O2)CO)O)O)O)C=C | 418.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Iridoid O-glycosides | |||||
| (1S,4aS,6S,7R,7aS)-6-hydroxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate | 25244401 | Click to see CC1C(CC2C1C(OC=C2C(=O)[O-])OC3C(C(C(C(O3)CO)O)O)O)O | 375.35 | unknown | via CMAUP database |
| 8-Epiloganic acid | 158144 | Click to see CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)O | 376.36 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4014484/ |
| 8-Epiloganin | 10548420 | Click to see CC1C(CC2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O | 390.40 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| Arbortristoside-B | 5459045 | Click to see COC(=O)C1=COC(C2C1C(C(C2CO)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)OC4C(C(C(C(O4)CO)O)O)O | 584.50 | unknown | via CMAUP database |
| Loganic acid | 89640 | Click to see CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)O | 376.36 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4014484/ |
| Loganicacid | 45358135 | Click to see CC1C(CC2C1C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)O | 376.36 | unknown | via CMAUP database |
| Loganin | 87691 | Click to see CC1C(CC2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O | 390.40 | unknown |
https://doi.org/10.1016/J.FITOTE.2006.04.011 https://doi.org/10.1021/NP800040K https://doi.org/10.1016/S0031-9422(99)00426-4 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4014484/ https://doi.org/10.1248/CPB.36.3664 https://doi.org/10.1021/NP50125A020 https://doi.org/10.1016/S0031-9422(00)00279-X |
| methyl (1S,4aS,6R,7R,7aS)-6-hydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate | 71676045 | Click to see CC1C(CC2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O | 390.40 | unknown | via CMAUP database |
| methyl (1S,4aS,6S,7R,7aS)-1-[(2S,3R,4S,5S,6R)-6-[[(3R,4aS,5R,6S)-5-ethenyl-1-oxo-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-3-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-6-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate | 11093859 | Click to see CC1C(CC2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)COC4CC5C(C(OC=C5C(=O)O4)OC6C(C(C(C(O6)CO)O)O)O)C=C)O)O)O)O | 746.70 | unknown | https://doi.org/10.1248/CPB.50.1041 |
| methyl (1S,4aS,6S,7R,7aS)-6-hydroxy-7-methyl-1-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate | 16212335 | Click to see CC1C(CC2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O | 390.40 | unknown | via CMAUP database |
| methyl (1S,4aS,6S,7R,7aS)-6-hydroxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate | 354446 | Click to see CC1C(CC2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O | 390.40 | unknown | via CMAUP database |
| methyl (1S,4aS,6S,7S,7aR)-6-hydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate | 35755834 | Click to see CC1C(CC2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O | 390.40 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| methyl 1-[6-[[5-ethenyl-1-oxo-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-3-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-6-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate | 85396765 | Click to see CC1C(CC2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)COC4CC5C(C(OC=C5C(=O)O4)OC6C(C(C(C(O6)CO)O)O)O)C=C)O)O)O)O | 746.70 | unknown | https://doi.org/10.1248/CPB.50.1041 |
| Methyl 6-hydroxy-7-methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate | 601562 | Click to see CC1C(CC2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O | 390.40 | unknown |
https://doi.org/10.1016/S0031-9422(99)00426-4 https://doi.org/10.1016/S0031-9422(00)00279-X https://doi.org/10.1021/NP800040K https://doi.org/10.1248/CPB.36.3664 |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins | |||||
| (6aS,9R)-9-[[(2R,3R,4S,5R,6R)-4-[(2S,3R,4R,5S,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-10-hydroxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 11968714 | Click to see CC1C(C(C(C(O1)OC2C(C(OC(C2O)OCC3(C4CCC5(C(C4(CCC3O)C)CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)O)C)C)C)CO)O)OC8C(C(C(CO8)O)O)O)O)O | 913.10 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 101529182 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)CO)O)O)O)C)C)C)O)O)O)O)O | 913.10 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] (4aS,6aR,6aS,6bR,12aR,14bR)-10-[(2S,3R,4S,5S)-4,5-bis[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 44146564 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)C)C)OC1C(C(C(C(O1)CO)O)O)O)OC1C(C(C(C(O1)CO)O)O)O)O)O)O | 1399.50 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] (4aS,6aS,6bR,9R,10S,12aR)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 3084573 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)C)C)O)O)O)O)O | 1075.20 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] 10-[(2R,3R,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 11968513 | Click to see CC1C(C(C(C(O1)OC2C(C(OC(C2O)OC3C(OC(C(C3O)O)OC4CCC5(C(C4(C)CO)CCC6(C5CC=C7C6(CCC8(C7CC(CC8)(C)C)C(=O)OC9C(C(C(C(O9)COC1C(C(C(C(O1)CO)O)O)O)O)O)O)C)C)C)CO)CO)O)OC1C(C(C(CO1)O)O)O)O)O | 1399.50 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 101623720 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)C2C1)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C | 1075.20 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 102004439 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)C)C)OC1C(C(C(C(O1)CO)O)O)O)OC1C(C(C(C(O1)CO)O)O)O)O)O)O | 1399.50 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 101623723 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(CO6)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)C2C1)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C | 1091.20 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] (4aS,6aS,6bR,9R,10S,12aR)-10-[(2S,3R,4S,5S)-3-[(2S,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 3086656 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)C)C)O)O)O)OC1C(C(C(C(O1)CO)O)O)O)O | 1237.40 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] 10-[(2S,3R,4S,5R)-3-[(2S,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 11968514 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)C)C)O)O)O)OC1C(C(C(C(O1)CO)O)O)O)O | 1237.40 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-4,5-dihydroxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 101447521 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(C(O6)CO)O)O)O)C)C)C2C1)C)C(=O)OC7C(C(C(C(O7)COC8C(C(C(CO8)O)O)O)O)O)OC9C(C(C(C(O9)CO)O)O)O)C | 1091.20 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-6-[[(2R,3R,4R,5S)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 154496921 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C7(CCC(C(C7CCC6(C5(CC4)C)C)(C)CO)OC8C(C(C(C(O8)CO)O)O)O)C)(C)C)COC9C(C(C(CO9)O)O)O)O)O)O)O)O | 1075.20 | unknown | https://doi.org/10.1248/CPB.51.333 |
| [(2S,3R,4S,5S,6R)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl] (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 72945687 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CCC4(C(C3(C)C)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(CO9)O)O)O)O)O)OC1C(C(C(C(O1)C)O)O)O)C)C)C)CO)O)O)O)O)O | 1205.40 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bR)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162979291 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(CO9)O)O)O)O)O)OC1C(C(C(C(O1)C)O)O)O)C)C)C)O)O)O)O)O | 1191.30 | unknown | https://doi.org/10.1016/S0031-9422(00)90656-3 |
| [(2S,3R,4S,5S,6R)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bR)-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 163017646 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C7(CCC(C(C7CCC6(C5(CC4)C)C)(C)CO)OC8C(C(C(CO8)O)O)O)C)(C)C)COC9C(C(C(CO9)O)O)O)O)O)O)O)O | 1045.20 | unknown | https://doi.org/10.1016/S0031-9422(00)90656-3 |
| [(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 72945298 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C7(CCC(C(C7CCC6(C5(CC4)C)C)(C)CO)OC8C(C(C(C(O8)CO)O)O)O)C)(C)C)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)O)O | 1105.30 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-6-[[(2R,3R,4S,5S,6R)-6-(acetyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 101623725 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)COC(=O)C)O)O)O)O)O)O)C)C)C)O)O)O)O)O | 1117.30 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| [(2S,3R,4S,5S,6R)-6-[[(2S,3R,4S,5R)-4-acetyloxy-3,5-dihydroxyoxan-2-yl]oxymethyl]-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 72945098 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C7(CCC(C(C7CCC6(C5(CC4)C)C)(C)CO)OC8C(C(C(C(O8)CO)O)O)O)C)(C)C)COC9C(C(C(CO9)O)OC(=O)C)O)O)O)O)O)O | 1117.30 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-6-[[(2S,3R,4S,5R)-4-acetyloxy-3,5-dihydroxyoxan-2-yl]oxymethyl]-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 72945299 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C7(CCC(C(C7CCC6(C5(CC4)C)C)(C)CO)OC8C(C(C(CO8)O)O)O)C)(C)C)COC9C(C(C(CO9)O)OC(=O)C)O)O)O)O)O)O | 1087.20 | unknown | via CMAUP database |
| [(3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-3-[(2S,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 118705383 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)C)C)O)O)O)OC1C(C(C(C(O1)CO)O)O)O)O | 1237.40 | unknown | via CMAUP database |
| [3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 10-[4,5-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 14284440 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)CO)O)O)O)C)C)C)O)O)O)O)O | 913.10 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| [3,4,5-Trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] 10-[4,5-bis[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 74933950 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)C)C)OC1C(C(C(C(O1)CO)O)O)O)OC1C(C(C(C(O1)CO)O)O)O)O)O)O | 1399.50 | unknown | via CMAUP database |
| [3,4,5-Trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] 10-[4,5-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 14284457 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)C)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)C)C)O)O)O)O)O | 1059.20 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| [3,4,5-Trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] 10-[4,5-dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 14284454 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)C2C1)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C | 1075.20 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| [3,4,5-Trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl] 10-[4,5-dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 14284437 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(CO6)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)C2C1)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C | 1091.20 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| [4,5-Dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxan-2-yl] 10-[4,5-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 85106438 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(CO9)O)O)O)O)O)OC1C(C(C(C(O1)C)O)O)O)C)C)C)O)O)O)O)O | 1191.30 | unknown | https://doi.org/10.1016/S0031-9422(00)90656-3 |
| [4,5-Dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxan-2-yl] 9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-(3,4,5-trihydroxyoxan-2-yl)oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 163017645 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C7(CCC(C(C7CCC6(C5(CC4)C)C)(C)CO)OC8C(C(C(CO8)O)O)O)C)(C)C)COC9C(C(C(CO9)O)O)O)O)O)O)O)O | 1045.20 | unknown | https://doi.org/10.1016/S0031-9422(00)90656-3 |
| [4,5-Dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxan-2-yl] 9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 85092182 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C7(CCC(C(C7CCC6(C5(CC4)C)C)(C)CO)OC8C(C(C(C(O8)CO)O)O)O)C)(C)C)COC9C(C(C(CO9)O)O)O)O)O)O)O)O | 1075.20 | unknown | https://doi.org/10.1248/CPB.51.333 |
| [6-[[6-(Acetyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] 10-[4,5-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 14284447 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)COC(=O)C)O)O)O)O)O)O)C)C)C)O)O)O)O)O | 1117.30 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| 28-[Glucosyl-(1->6)-glucosyl]oleanolic acid 3-arabinoside | 14284451 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)O)O)C)C)C2C1)C)C(=O)OC7C(C(C(C(O7)COC8C(C(C(C(O8)CO)O)O)O)O)O)O)C | 913.10 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| 3beta-(beta-D-Glucopyranosyloxy)oleana-12-ene-28-oic acid 2-O-alpha-L-rhamnopyranosyl-6-O-beta-D-xylopyranosyl-beta-D-glucopyranosyl ester | 101447522 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C7(CCC(C(C7CCC6(C5(CC4)C)C)(C)C)OC8C(C(C(C(O8)CO)O)O)O)C)(C)C)COC9C(C(C(CO9)O)O)O)O)O)O)O)O | 1059.20 | unknown | via CMAUP database |
| Anhuienside C | 21629979 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)C)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)C)C)O)O)O)O)O | 1059.20 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| Asperosaponin VI | 14284436 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(CO6)O)O)O)C)C)C2C1)C)C(=O)OC7C(C(C(C(O7)COC8C(C(C(C(O8)CO)O)O)O)O)O)O)C | 929.10 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| CID 14284432 | 14284432 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(CO6)O)O)O)C)C)C2C1)C)C(=O)OC7C(C(C(C(O7)COC8C(C(C(C(O8)CO)O)O)O)O)O)O)C | 929.10 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| Dipsacoside B | 21627940 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)C)C)O)O)O)O)O | 1075.20 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| DipsacosideB | 14284443 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)C)C)O)O)O)O)O | 1075.20 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| Loniceroside A | 10102583 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C7(CCC(C(C7CCC6(C5(CC4)C)C)(C)CO)OC8C(C(C(CO8)O)O)O)C)(C)C)COC9C(C(C(CO9)O)O)O)O)O)O)O)O | 1045.20 | unknown | via CMAUP database |
| Loniceroside B | 10057143 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(CO9)O)O)O)O)O)OC1C(C(C(C(O1)C)O)O)O)C)C)C)O)O)O)O)O | 1191.30 | unknown |
https://doi.org/10.1016/J.FITOTE.2006.04.011 https://doi.org/10.1016/S0031-9422(00)90656-3 |
| Loniceroside C | 101227977 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C7(CCC(C(C7CCC6(C5(CC4)C)C)(C)CO)OC8C(C(C(C(O8)CO)O)O)O)C)(C)C)COC9C(C(C(CO9)O)O)O)O)O)O)O)O | 1075.20 | unknown | https://doi.org/10.1248/CPB.51.333 |
| Loniceroside H | 72945099 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC(=O)C34CCC(CC3C5=CCC6C7(CCC(C(C7CCC6(C5(CC4)C)C)(C)CO)OC8C(C(C(C(O8)CO)O)O)O)C)(C)C)COC9C(C(C(CO9)OC(=O)C)O)O)O)O)O)O)O | 1117.30 | unknown | via CMAUP database |
| Macranthoidin A | 14564503 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O)C)C)C)O)O)O)OC1C(C(C(C(O1)CO)O)O)O)O | 1237.40 | unknown | via CMAUP database |
| Olean-12-en-28-oic acid, 3-(alpha-L-arabinopyranosyloxy)-, 6-O-beta-D-glucopyranosyl-beta-D-glucopyranosyl ester, (3beta)- | 101623719 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)O)O)C)C)C2C1)C)C(=O)OC7C(C(C(C(O7)COC8C(C(C(C(O8)CO)O)O)O)O)O)O)C | 913.10 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| > Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Carotenes | |||||
| 1,3,3-trimethyl-2-[(1E,3E,5E,7E,9E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene | 152743364 | Click to see CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2=C(CCCC2(C)C)C)C)C | 536.90 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1197872/ |
| Beta-Carotene | 5280489 | Click to see CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2=C(CCCC2(C)C)C)C)C | 536.90 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1197872/ |
| CID 10121 | 10121 | Click to see CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)CCC=C(C)C)C)C | 536.90 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1197872/ |
| CID 156047 | 156047 | Click to see CC(=CCCC(=CCCC(=CC=CC(=CC=CC=C(C)C=CC=C(C)CCC=C(C)CCC=C(C)C)C)C)C)C | 540.90 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1197872/ |
| gamma-Carotene | 5280791 | Click to see CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)CCC=C(C)C)C)C | 536.90 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1197872/ |
| Ibr-clc | 6857557 | Click to see CC(=CCCC(=CCCC(=CCCC(=CC=CC=C(C)C=CC=C(C)CCC=C(C)CCC=C(C)C)C)C)C)C | 542.90 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1197872/ |
| zeta-Carotene | 5280788 | Click to see CC(=CCCC(=CCCC(=CC=CC(=CC=CC=C(C)C=CC=C(C)CCC=C(C)CCC=C(C)C)C)C)C)C | 540.90 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1197872/ |
| > Lipids and lipid-like molecules / Prenol lipids / Triterpenoids | |||||
| (10R)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid | 45358157 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O | 456.70 | unknown | via CMAUP database |
| (1R,2R,4aS,6aR,6aS,6bR,8aS,10S,11R,12aR,14bS)-1,10,11-trihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 93473213 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1(C)O)C)C(=O)O | 488.70 | unknown | https://doi.org/10.1021/NP800040K |
| (1S,2R,4aR,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid | 45483617 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O | 456.70 | unknown | via CMAUP database |
| (25R)-5alpha-spirostan-3beta,6alpha-diol | 52931478 | Click to see CCC1C(CC2C1(CCC3C2CC(C4C3(CCC(C4)O)C)O)C)OC5(CCC(CO5)C)C | 448.70 | unknown | via CMAUP database |
| (4aS,6aR,6aS,6bR,9R,10S,12aR,14bR)-10-hydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 53487826 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C2C1)C)C(=O)O)C | 472.70 | unknown | via CMAUP database |
| 10-[4,5-Dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 267360 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)O)C)C)C)O)O)O)O)O | 751.00 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| 10-[4,5-Dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 13878149 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(CO6)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)C2C1)C)C(=O)O)C | 767.00 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| 9-(Hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-(3,4,5-trihydroxyoxan-2-yl)oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 4483448 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(CO6)O)O)O)C)C)C2C1)C)C(=O)O)C | 604.80 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| alpha-Hederin | 73296 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)O)C)C)C)O)O)O)O)O | 751.00 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| Cauloside A | 441928 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(CO6)O)O)O)C)C)C2C1)C)C(=O)O)C | 604.80 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| Cauloside C | 13878151 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)OC6C(C(C(CO6)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)C2C1)C)C(=O)O)C | 767.00 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| Forpinioside A | 146682766 | Click to see CC(C)C(=C)CCC(C1CCC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)OC(=O)CC(C)(CC(=O)OC)O)C)C)C)C(=O)OC5C(C(C(CO5)O)O)O | 761.00 | unknown | https://doi.org/10.1021/NP800040K |
| Hederagenin | 73299 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C2C1)C)C(=O)O)C | 472.70 | unknown | via CMAUP database |
| Oleanolic acid-3-O-beta-D-glucopyranosyl (1-->2)-alpha-L-arabinopyranoside | 494511 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)C2C1)C)C(=O)O)C | 751.00 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| Saponin PE | 13878145 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(CO6)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)C2C1)C)C(=O)O)C | 751.00 | unknown | https://doi.org/10.1248/CPB.36.4769 |
| Ursolic Acid | 64945 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O | 456.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Saccharolipids | |||||
| [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(2-methoxy-4-prop-2-enylphenoxy)oxan-2-yl]methyl 2-[(3R,4aS,5R,6S)-5-ethenyl-1-oxo-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-3-yl]acetate | 102193291 | Click to see COC1=C(C=CC(=C1)CC=C)OC2C(C(C(C(O2)COC(=O)CC3CC4C(C(OC=C4C(=O)O3)OC5C(C(C(C(O5)CO)O)O)O)C=C)O)O)O | 724.70 | unknown | via CMAUP database |
| methyl (2S,3R,4S)-3-ethenyl-4-[(E)-4-methoxy-4-oxobut-1-enyl]-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate | 11144737 | Click to see COC(=O)CC=CC1C(C(OC=C1C(=O)OC)OC2C(C(C(C(O2)CO)O)O)O)C=C | 444.40 | unknown | via CMAUP database |
| methyl (2S,3R,4S)-3-ethenyl-4-[(E)-4-oxo-4-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(2-methoxy-4-prop-2-enylphenoxy)oxan-2-yl]methoxy]but-1-enyl]-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylate | 101792585 | Click to see COC1=C(C=CC(=C1)CC=C)OC2C(C(C(C(O2)COC(=O)CC=CC3C(C(OC=C3C(=O)OC)OC4C(C(C(C(O4)CO)O)O)O)C=C)O)O)O | 738.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Sphingolipids / Ceramides | |||||
| 2-hydroxy-N-(1,3,5,6-tetrahydroxyhexacos-9-en-2-yl)pentadecanamide | 162905224 | Click to see CCCCCCCCCCCCCCCCC=CCCC(C(CC(C(CO)NC(=O)C(CCCCCCCCCCCCC)O)O)O)O | 684.10 | unknown | https://doi.org/10.1016/J.TET.2006.02.070 |
| 2-hydroxy-N-(1,3,5,6-tetrahydroxyoctacos-9-en-2-yl)octadecanamide | 163053811 | Click to see CCCCCCCCCCCCCCCCCCC=CCCC(C(CC(C(CO)NC(=O)C(CCCCCCCCCCCCCCCC)O)O)O)O | 754.20 | unknown | https://doi.org/10.1016/J.TET.2006.02.070 |
| > Lipids and lipid-like molecules / Sphingolipids / Glycosphingolipids | |||||
| (2R)-2-hydroxy-N-[(E,2S,3S,5R,6S)-3,5,6-trihydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexacos-9-en-2-yl]hexadecanamide | 162930247 | Click to see CCCCCCCCCCCCCCCCC=CCCC(C(CC(C(COC1C(C(C(C(O1)CO)O)O)O)NC(=O)C(CCCCCCCCCCCCCC)O)O)O)O | 860.30 | unknown | https://doi.org/10.1016/J.TET.2006.02.070 |
| (2R)-N-[(E,2S,3S,5R,6S)-1-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,5,6-trihydroxyoctacos-9-en-2-yl]-2-hydroxyoctadecanamide | 162923259 | Click to see CCCCCCCCCCCCCCCCCCC=CCCC(C(CC(C(COC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)CO)O)O)O)O)O)NC(=O)C(CCCCCCCCCCCCCCCC)O)O)O)O | 1078.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.070 |
| 2-hydroxy-N-[3,5,6-trihydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexacos-9-en-2-yl]hexadecanamide | 162930246 | Click to see CCCCCCCCCCCCCCCCC=CCCC(C(CC(C(COC1C(C(C(C(O1)CO)O)O)O)NC(=O)C(CCCCCCCCCCCCCC)O)O)O)O | 860.30 | unknown | https://doi.org/10.1016/J.TET.2006.02.070 |
| N-[1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,5,6-trihydroxyoctacos-9-en-2-yl]-2-hydroxyoctadecanamide | 162923258 | Click to see CCCCCCCCCCCCCCCCCCC=CCCC(C(CC(C(COC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)CO)O)O)O)O)O)NC(=O)C(CCCCCCCCCCCCCCCC)O)O)O)O | 1078.50 | unknown | https://doi.org/10.1016/J.TET.2006.02.070 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives | |||||
| (24R)-Methylcholest-5-en-3beta-ol | 6428659 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 400.70 | unknown | via CMAUP database |
| 22,23-Dihydrobrassicasterol | 5283637 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 400.70 | unknown | via CMAUP database |
| 5-Cholestene-3-ol, 24-methyl- | 312822 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 400.70 | unknown | via CMAUP database |
| Campesterol | 173183 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 400.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Pregnane steroids / Gluco/mineralocorticoids, progestogins and derivatives | |||||
| Progesterone | 5994 | Click to see CC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C | 314.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides / Steroidal saponins | |||||
| (1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,16S,18S)-16-[(2R,3R,4R,5R,6R)-5-[(2S,3R,4S,5R,6R)-4-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-10-one | 10606686 | Click to see CC1CCC2(C(C3C(O2)CC4C3(C(=O)CC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)OC9C(C(C(C(O9)CO)OC2C(C(C(C(O2)C)O)O)O)O)O)OC2C(C(C(C(O2)CO)O)O)O)O)O)C)C)C)OC1 | 1225.30 | unknown | https://doi.org/10.1021/NP800040K |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives | |||||
| (2S,3R,4S,5R)-2-[[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]oxane-3,4,5-triol | 6326040 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(CO5)O)O)O)C)C)C(C)C | 546.80 | unknown | via CMAUP database |
| (3R,8R,9R,10S,13R,14R,17R)-17-[(E,2R,5R)-5-ethyl-6-methylhept-3-en-2-yl]-3,10,13-trimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene | 50930798 | Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)C)C)C)C(C)C | 410.70 | unknown | via CMAUP database |
| (3S,8R,9R,10S,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 636741 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C | 414.70 | unknown | via CMAUP database |
| Sitogluside | 5742590 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C | 576.80 | unknown | via CMAUP database |
| > Nucleosides, nucleotides, and analogues / Purine nucleosides | |||||
| 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one | 6802 | Click to see C1=NC2=C(N1C3C(C(C(O3)CO)O)O)NC(=NC2=O)N | 283.24 | unknown | via CMAUP database |
| 5'-O-Methyladenosine | 6480505 | Click to see COCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O | 281.27 | unknown | via CMAUP database |
| Adenosine | 60961 | Click to see C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N | 267.24 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Phenylalanine and derivatives | |||||
| (2S)-2-[(3S,4R,4aS)-4-ethenyl-8-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyridin-7-yl]-3-phenylpropanoic acid | 66552683 | Click to see C=CC1C2CCN(C(=O)C2=COC1OC3C(C(C(C(O3)CO)O)O)O)C(CC4=CC=CC=C4)C(=O)O | 505.50 | unknown | via CMAUP database |
| methyl (2S)-2-[(3S,4R,4aS)-4-ethenyl-8-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyridin-7-yl]-3-phenylpropanoate | 66552684 | Click to see COC(=O)C(CC1=CC=CC=C1)N2CCC3C(C(OC=C3C2=O)OC4C(C(C(C(O4)CO)O)O)O)C=C | 519.50 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid amides / Tertiary carboxylic acid amides | |||||
| N,N-Dimethylacetamide | 31374 | Click to see CC(=O)N(C)C | 87.12 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters | |||||
| cis-3-Hexenyl acetate | 5363388 | Click to see CCC=CCCOC(=O)C | 142.20 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| Hexyl Acetate | 8908 | Click to see CCCCCCOC(=O)C | 144.21 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| trans-3-Hexenyl acetate | 5352557 | Click to see CCC=CCCOC(=O)C | 142.20 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters / Enol esters | |||||
| [(1E)-2,6-dimethylhepta-1,5-dienyl] acetate | 24832062 | Click to see CC(=CCCC(=COC(=O)C)C)C | 182.26 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acids | |||||
| Acetate | 175 | Click to see CC(=O)[O-] | 59.04 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives | |||||
| (1R,3R,4S,5R)-3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxycyclohexane-1-carboxylic acid | 91492 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | via CMAUP database |
| (1R,3R,4S,5R)-3,4-bis[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,5-dihydroxycyclohexane-1-carboxylic acid | 460890 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O | 516.40 | unknown | via CMAUP database |
| (1R,3R,4S,5S)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid | 11870310 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | via CMAUP database |
| (1S,3R,4R,5R)-3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxy-cyclohexanecarboxylic acid | 9476 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | via CMAUP database |
| (1S,3R,4S,5R)-3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxycyclohexane-1-carboxylic acid | 73081 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | via CMAUP database |
| 1,3-Dicaffeoylquinic acid | 6474640 | Click to see C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O)O | 516.40 | unknown | via CMAUP database |
| 1,4-Dicaffeoylquinic acid | 12358846 | Click to see C1C(C(C(CC1(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O | 516.40 | unknown | via CMAUP database |
| 3-O-p-Coumaroylquinic acid | 14158103 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC=C(C=C2)O)O)O | 338.31 | unknown | via CMAUP database |
| 3,4-Dicaffeoyl Quinic Acid | 10324242 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O | 516.40 | unknown | via CMAUP database |
| 3,4-Dicaffeoylquinic acid | 6474309 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O | 516.40 | unknown | via CMAUP database |
| 3,5-Di-caffeoylquinic acid | 13604688 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O | 516.40 | unknown | via CMAUP database |
| 4,5-Dicaffeoyl quinic acid | 13887346 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O | 516.40 | unknown | via CMAUP database |
| 4,5-Dicaffeoylquinic acid | 5281780 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O | 516.40 | unknown | via CMAUP database |
| 5-p-Coumaroylquinic acid, (Z)- | 90478782 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC=C(C=C2)O)O)O | 338.31 | unknown | via CMAUP database |
| Butyl chlorogenate | 12135130 | Click to see CCCCOC(=O)C1(CC(C(C(C1)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O)O | 410.40 | unknown | via CMAUP database |
| Chlorogenic Acid | 1794427 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | via CMAUP database |
| Chlorogensaure | 12310830 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | via CMAUP database |
| cis-Chlorogenic acid | 1794425 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | via CMAUP database |
| Cryptochlorogenic acid | 9798666 | Click to see C1C(C(C(CC1(C(=O)O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O | 354.31 | unknown | via CMAUP database |
| Dicaffeoyl quinic acid | 13604687 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O | 516.40 | unknown | via CMAUP database |
| Isochlorogenic acid | 6436237 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | https://doi.org/10.1016/J.ETAP.2014.10.019 |
| Isochlorogenic acid | 5315832 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | via CMAUP database |
| Isochlorogenic acid A | 6474310 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O | 516.40 | unknown | via CMAUP database |
| Isochlorogensaure | 12310829 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | via CMAUP database |
| Macrathoin F | 5319161 | Click to see COC(=O)C1(CC(C(C(C1)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O | 530.50 | unknown | via CMAUP database |
| methyl (1R,3R,4S)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylate | 10768548 | Click to see COC(=O)C1(CC(C(C(C1)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O)O | 530.50 | unknown | via CMAUP database |
| Methyl chlorogenate | 6476139 | Click to see COC(=O)C1(CC(C(C(C1)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O)O | 368.30 | unknown | via CMAUP database |
| Neochlorogenic acid | 5280633 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | https://doi.org/10.1016/S0367-326X(00)00212-4 |
| trans-5-O-(4-coumaroyl)-D-quinic acid | 6441280 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC=C(C=C2)O)O)O | 338.31 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Primary alcohols | |||||
| (S)-(-)-2-Methyl-1-butanol | 2723602 | Click to see CCC(C)CO | 88.15 | unknown | via CMAUP database |
| 2-Methyl-1-butanol | 8723 | Click to see CCC(C)CO | 88.15 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols | |||||
| (2R)-2-hydroxy-N-[(E,2S,3S,5R,6S)-1,3,5,6-tetrahydroxyhexacos-9-en-2-yl]pentadecanamide | 162905225 | Click to see CCCCCCCCCCCCCCCCC=CCCC(C(CC(C(CO)NC(=O)C(CCCCCCCCCCCCC)O)O)O)O | 684.10 | unknown | https://doi.org/10.1016/J.TET.2006.02.070 |
| (2R)-2-hydroxy-N-[(E,2S,3S,5R,6S)-1,3,5,6-tetrahydroxyoctacos-9-en-2-yl]octadecanamide | 163053812 | Click to see CCCCCCCCCCCCCCCCCCC=CCCC(C(CC(C(CO)NC(=O)C(CCCCCCCCCCCCCCCC)O)O)O)O | 754.20 | unknown | https://doi.org/10.1016/J.TET.2006.02.070 |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols / Cyclohexanols | |||||
| (2R,3S,5R,6R)-(113C)cyclohexane-1,2,3,4,5,6-hexol | 11973225 | Click to see C1(C(C(C(C(C1O)O)O)O)O)O | 181.15 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols | |||||
| 5-(3,3-Dimethyloxiran-2-yl)-3-methylpent-1-en-3-ol | 529304 | Click to see CC1(C(O1)CCC(C)(C=C)O)C | 170.25 | unknown | via CMAUP database |
| Hotrienol | 5366264 | Click to see CC(=C)C=CCC(C)(C=C)O | 152.23 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Cyanogenic glycosides | |||||
| Linamarin | 11128 | Click to see CC(C)(C#N)OC1C(C(C(C(O1)CO)O)O)O | 247.24 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds | |||||
| (2S,3R,4S,5S,6R)-2-[[(3S,4R,4aS,6R)-4-ethenyl-6-methoxy-3,4,4a,5,6,8-hexahydropyrano[3,4-c]pyran-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol | 162878993 | Click to see COC1CC2C(C(OC=C2CO1)OC3C(C(C(C(O3)CO)O)O)O)C=C | 374.40 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| (2S,3R,4S,5S,6R)-2-[[(3S,4R,4aS,6S)-4-ethenyl-6-methoxy-3,4,4a,5,6,8-hexahydropyrano[3,4-c]pyran-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol | 162878992 | Click to see COC1CC2C(C(OC=C2CO1)OC3C(C(C(C(O3)CO)O)O)O)C=C | 374.40 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| (2S,3R,4S,5S,6R)-2-[[(3S,4R,4aS)-4-ethenyl-3,4,4a,5,6,8-hexahydropyrano[3,4-c]pyran-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol | 163035925 | Click to see C=CC1C2CCOCC2=COC1OC3C(C(C(C(O3)CO)O)O)O | 344.36 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| (3R,4aS,5S,6S)-5-ethenyl-3-methoxy-6-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one | 154497682 | Click to see COC1CC2C(C(OC=C2C(=O)O1)OC3C(C(C(C(O3)CO)O)O)O)C=C | 388.40 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| (3R,4S,4aR)-4-ethenyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-8-one | 9906781 | Click to see C=CC1C2CCOC(=O)C2=COC1OC3C(C(C(C(O3)CO)O)O)O | 358.34 | unknown | via CMAUP database |
| (3S,4aS,5S,6S)-5-ethenyl-3-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one | 154496519 | Click to see COC1CC2C(C(OC=C2C(=O)O1)OC3C(C(C(C(O3)CO)O)O)O)C=C | 388.40 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| (3S,4R,4aS)-4-ethenyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-8-one | 354447 | Click to see C=CC1C2CCOC(=O)C2=COC1OC3C(C(C(C(O3)CO)O)O)O | 358.34 | unknown |
https://doi.org/10.1021/NP800040K https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4014484/ https://doi.org/10.1021/NP50125A020 https://doi.org/10.1016/S0031-9422(00)00279-X |
| (3S,4S,4aS)-4-ethenyl-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-8-one | 154497536 | Click to see C=CC1C2CCOC(=O)C2=COC1OC3C(C(C(C(O3)CO)O)O)O | 358.34 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| (7Alpha-Hydroxy)-Morroniside | 21593530 | Click to see CC1C2C(CC(O1)O)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OC | 406.40 | unknown | https://doi.org/10.1021/NP800040K |
| [(4aS,8S,8aS)-1-methyl-3-oxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,8,8a-tetrahydro-1H-pyrano[3,4-c]pyran-5-yl] acetate | 6325484 | Click to see CC1C2C(CC(=O)O1)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)OC(=O)C | 404.40 | unknown |
https://doi.org/10.1016/S0031-9422(00)00279-X https://doi.org/10.1021/NP800040K |
| 2-[(4-Ethenyl-3,4,4a,5,6,8-hexahydropyrano[3,4-c]pyran-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol | 163035924 | Click to see C=CC1C2CCOCC2=COC1OC3C(C(C(C(O3)CO)O)O)O | 344.36 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| 2-[(4-Ethenyl-6-methoxy-3,4,4a,5,6,8-hexahydropyrano[3,4-c]pyran-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol | 162878991 | Click to see COC1CC2C(C(OC=C2CO1)OC3C(C(C(C(O3)CO)O)O)O)C=C | 374.40 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| 4-ethenyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-8-one | 581257 | Click to see C=CC1C2CCOC(=O)C2=COC1OC3C(C(C(C(O3)CO)O)O)O | 358.34 | unknown | https://doi.org/10.1021/NP800040K |
| 5-ethenyl-3-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-1-one | 101939796 | Click to see COC1CC2C(C(OC=C2C(=O)O1)OC3C(C(C(C(O3)CO)O)O)O)C=C | 388.40 | unknown |
https://doi.org/10.1248/CPB.36.3664 https://doi.org/10.1016/S0031-9422(00)00279-X |
| 5-Ethenyl-6-(beta-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-3-methoxy-1H,3H-pyrano[3,4-c]pyran-1-one | 14192589 | Click to see COC1CC2C(C(OC=C2C(=O)O1)OC3C(C(C(C(O3)CO)O)O)O)C=C | 388.40 | unknown | https://doi.org/10.1248/CPB.36.3664 |
| 7-epi-Vogeloside | 102183193 | Click to see COC1CC2C(C(OC=C2C(=O)O1)OC3C(C(C(C(O3)CO)O)O)O)C=C | 388.40 | unknown | via CMAUP database |
| 7-epi-Vogeloside; Epivogeloside; Isovogeloside; Nervoside | 14192588 | Click to see COC1CC2C(C(OC=C2C(=O)O1)OC3C(C(C(C(O3)CO)O)O)O)C=C | 388.40 | unknown | https://doi.org/10.1248/CPB.36.3664 |
| CID 11228693 | 11228693 | Click to see CC1C2C(CC(O1)O)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OC | 406.40 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| CID 12312977 | 12312977 | Click to see CC1C2C(CC(O1)O)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OC | 406.40 | unknown | https://doi.org/10.1021/NP800040K |
| dimethyl (1R,2S,3S,7S,9R)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,12-dioxatricyclo[7.3.1.02,7]trideca-5,10-diene-6,10-dicarboxylate | 76331806 | Click to see COC(=O)C1=COC2CC1CC3C2C(OC=C3C(=O)OC)OC4C(C(C(C(O4)CO)O)O)O | 472.40 | unknown | via CMAUP database |
| Epivogeloside | 14192590 | Click to see COC1CC2C(C(OC=C2C(=O)O1)OC3C(C(C(C(O3)CO)O)O)O)C=C | 388.40 | unknown |
https://doi.org/10.1248/CPB.36.3664 https://doi.org/10.1016/S0031-9422(00)00279-X |
| Kingiside | 12304884 | Click to see CC1C2C(CC(=O)O1)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OC | 404.40 | unknown |
https://doi.org/10.1016/S0031-9422(00)00279-X https://doi.org/10.1021/NP800040K |
| Lonijaposide H | 56599868 | Click to see COC(=O)C1=COC(C(C1=CCC2=CC(=C[N+](=C2)CCCC(=O)O)C(=O)[O-])C=C)OC3C(C(C(C(O3)CO)O)O)O | 579.50 | unknown | https://doi.org/10.1021/NP2004566 |
| Loniphenyruviridoside A, (rel)- | 57395335 | Click to see C1C2CC(C3C1C(=COC3OC4C(C(C(C(O4)CO)O)O)O)C(=O)O)OC=C2C5=CC=CC=C5 | 476.50 | unknown | https://doi.org/10.1021/NP2004566 |
| methyl (1S,4aS,8S,8aS)-1-methyl-3-oxo-8-[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,8,8a-tetrahydro-1H-pyrano[3,4-c]pyran-5-carboxylate | 154496841 | Click to see CC1C2C(CC(=O)O1)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OC | 404.40 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| methyl (4aS,8aS)-3-hydroxy-1-methyl-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,4a,8,8a-hexahydropyrano[3,4-c]pyran-5-carboxylate | 138107798 | Click to see CC1C2C(CC(O1)O)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OC | 406.40 | unknown |
https://doi.org/10.1016/S0031-9422(00)00279-X https://doi.org/10.1021/NP800040K |
| methyl 1-methyl-3-oxo-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,8,8a-tetrahydro-1H-pyrano[3,4-c]pyran-5-carboxylate | 12304883 | Click to see CC1C2C(CC(=O)O1)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OC | 404.40 | unknown |
https://doi.org/10.1016/S0031-9422(00)00279-X https://doi.org/10.1021/NP800040K |
| Sweroside | 161036 | Click to see C=CC1C2CCOC(=O)C2=COC1OC3C(C(C(C(O3)CO)O)O)O | 358.34 | unknown |
https://doi.org/10.1021/NP800040K https://doi.org/10.1021/NP50125A020 https://doi.org/10.1016/S0031-9422(00)00279-X |
| Swertiamarin | 442435 | Click to see C=CC1C(OC=C2C1(CCOC2=O)O)OC3C(C(C(C(O3)CO)O)O)O | 374.34 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4014484/ |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides | |||||
| (2E)-3-(3-hydroxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid | 54150205 | Click to see C1=CC(=C(C=C1C=CC(=O)O)O)OC2C(C(C(C(O2)CO)O)O)O | 342.30 | unknown | via CMAUP database |
| 5-(beta-D-glucopyranosyloxy)-2-hydroxybenzoic acid | 10914066 | Click to see C1=CC(=C(C=C1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)O | 316.26 | unknown | via CMAUP database |
| benzyl 2-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoate | 636610 | Click to see C1=CC=C(C=C1)COC(=O)C2=C(C=CC=C2OC3C(C(C(C(O3)CO)O)O)O)O | 406.40 | unknown | via CMAUP database |
| Eleutheroside B | 5316860 | Click to see COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C=CCO | 372.40 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Aryl-aldehydes | |||||
| (5-Formylfuran-3-yl)methyl phosphate | 25201088 | Click to see C1=C(OC=C1COP(=O)([O-])[O-])C=O | 204.07 | unknown | via CMAUP database |
| 5-Methylfurfural | 12097 | Click to see CC1=CC=C(O1)C=O | 110.11 | unknown | via CMAUP database |
| Furfural | 7362 | Click to see C1=COC(=C1)C=O | 96.08 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes | |||||
| (Z)-2-hexenal | 6428782 | Click to see CCCC=CC=O | 98.14 | unknown | via CMAUP database |
| 2-Hexenal | 5281168 | Click to see CCCC=CC=O | 98.14 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| Heptanal | 8130 | Click to see CCCCCCC=O | 114.19 | unknown | via CMAUP database |
| Hexanal | 6184 | Click to see CCCCCC=O | 100.16 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzaldehydes / Hydroxybenzaldehydes | |||||
| 4-Hydroxybenzaldehyde | 126 | Click to see C1=CC(=CC=C1C=O)O | 122.12 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones | |||||
| (E)-jasmone | 1549019 | Click to see CCC=CCC1=C(CCC1=O)C | 164.24 | unknown | via CMAUP database |
| 2-But-2-enyl-3-methylcyclopent-2-en-1-one | 591418 | Click to see CC=CCC1=C(CCC1=O)C | 150.22 | unknown | via CMAUP database |
| Jasmone | 1549018 | Click to see CCC=CCC1=C(CCC1=O)C | 164.24 | unknown |
https://doi.org/10.1021/JF950275B https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones | |||||
| 2-Heptadecanone | 18027 | Click to see CCCCCCCCCCCCCCCC(=O)C | 254.50 | unknown | via CMAUP database |
| 2-Heptanone | 8051 | Click to see CCCCCC(=O)C | 114.19 | unknown | via CMAUP database |
| 2-Nonadecanone | 69423 | Click to see CCCCCCCCCCCCCCCCCC(=O)C | 282.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| 2-Pentadecanone | 61303 | Click to see CCCCCCCCCCCCCC(=O)C | 226.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| > Organic oxygen compounds / Organooxygen compounds / Enolates | |||||
| Hept-1-en-2-olate | 53630862 | Click to see C=C(CCCC[CH2+])[O-] | 112.17 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Ethers / Dialkyl ethers | |||||
| Decyl ether | 17152 | Click to see CCCCCCCCCCOCCCCCCCCCC | 298.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ |
| > Organic oxygen compounds / Organooxygen compounds / Ethers / Diarylethers | |||||
| Insularine | 10348927 | Click to see CN1CCC2=CC(=C3C4=C2C1CC5=CC=C(C=C5)OC6=C7C(CC8=CC(=C(O4)C=C8)CO3)N(CCC7=CC(=C6OC)OC)C)OC | 620.70 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Benzofurans / Benzofuranones / Phthalic anhydrides | |||||
| Phthalic anhydride | 6811 | Click to see C1=CC=C2C(=C1)C(=O)OC2=O | 148.11 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Diazines / Pyrimidines and pyrimidine derivatives / Hydroxypyrimidines | |||||
| 5-methylpyrimidine-2,4-diol | 5274265 | Click to see CC1=CN=C(N=C1O)O | 126.11 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Dihydrofurans / Furanones / Butenolides | |||||
| (5Z)-5-[(2R,3R)-2,3-dihydroxybutylidene]-3-[(2R)-2-hydroxypropyl]furan-2-one | 163017781 | Click to see CC(CC1=CC(=CC(C(C)O)O)OC1=O)O | 228.24 | unknown | https://doi.org/10.1248/CPB.50.1041 |
| > Organoheterocyclic compounds / Heteroaromatic compounds | |||||
| 2-Ethylfuran | 18554 | Click to see CCC1=CC=CO1 | 96.13 | unknown | via CMAUP database |
| 2-Pentylfuran | 19602 | Click to see CCCCCC1=CC=CO1 | 138.21 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Indoles and derivatives / Indoles | |||||
| Indole | 798 | Click to see C1=CC=C2C(=C1)C=CN2 | 117.15 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3443457/ https://doi.org/10.1021/JF950275B |
| > Organoheterocyclic compounds / Isocoumarans / Isobenzofuranones | |||||
| 1(3H)-Isobenzofuranone, 3-butylidene- | 62368 | Click to see CCCC=C1C2=CC=CC=C2C(=O)O1 | 188.22 | unknown | via CMAUP database |
| Butylidenephthalide | 5352899 | Click to see CCCC=C1C2=CC=CC=C2C(=O)O1 | 188.22 | unknown | via CMAUP database |
| Butylidenephthalide | 642376 | Click to see CCCC=C1C2=CC=CC=C2C(=O)O1 | 188.22 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Isoquinolines and derivatives | |||||
| Isoquinoline | 8405 | Click to see C1=CC=C2C=NC=CC2=C1 | 129.16 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| > Organoheterocyclic compounds / Lactones / Delta valerolactones | |||||
| Luteusin C | 10647674 | Click to see CCC(C)C=C(C)C=CC1=CC2=C(C(=O)C3(C(C2=CO1)C4C(=O)OC(CC4(O3)O)C)C)Cl | 460.90 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| > Organoheterocyclic compounds / Lactones / Gamma butyrolactones | |||||
| (3E,4S)-3-[2-[(1R,2R,4R,4aR,6S,8aS)-4,6-dihydroxy-5,5,8a-trimethylspiro[3,4,4a,6,7,8-hexahydro-1H-naphthalene-2,2'-oxirane]-1-yl]ethylidene]-4-hydroxyoxolan-2-one | 162922963 | Click to see CC1(C(CCC2(C1C(CC3(C2CC=C4C(COC4=O)O)CO3)O)C)O)C | 366.40 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| > Organoheterocyclic compounds / Oxepanes | |||||
| (1aR,2aS,4S,6aR,7S,7aR)-4-hydroxy-7-(hydroxymethyl)-3,3,6a,7a-tetramethyl-1a,2a,4,5,6,7-hexahydronaphtho[2,3-b]oxiren-2-one | 102090462 | Click to see CC1(C(CCC2(C1C(=O)C3C(C2CO)(O3)C)C)O)C | 268.35 | unknown | https://doi.org/10.1016/S0031-9422(00)00279-X |
| > Organoheterocyclic compounds / Oxolanes | |||||
| 2-Furanmethanol, 5-ethenyltetrahydro-alpha,alpha,5-trimethyl-, (2R,5R)-rel- | 6431475 | Click to see CC1(CCC(O1)C(C)(C)O)C=C | 170.25 | unknown | via CMAUP database |
| Lilac aldehyde, (2S,2'R,5'S)- | 16667664 | Click to see CC(C=O)C1CCC(O1)(C)C=C | 168.23 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyridines and derivatives | |||||
| 2-(3-Ethenylpyridin-4-yl)ethanol | 5317555 | Click to see C=CC1=C(C=CN=C1)CCO | 149.19 | unknown | via CMAUP database |
| 3-Ethylpyridine | 10823 | Click to see CCC1=CN=CC=C1 | 107.15 | unknown | via CMAUP database |
| 3-Vinylpyridine | 14272 | Click to see C=CC1=CN=CC=C1 | 105.14 | unknown | via CMAUP database |
| Pyridine | 1049 | Click to see C1=CC=NC=C1 | 79.10 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Tetrahydrofurans | |||||
| Lilac aldehyde | 155007 | Click to see CC(C=O)C1CCC(O1)(C)C=C | 168.23 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| Linalool oxide | 22310 | Click to see CC1(CCC(O1)C(C)(C)O)C=C | 170.25 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Cinnamic acids | |||||
| Cinnamic acid | 444539 | Click to see C1=CC=C(C=C1)C=CC(=O)O | 148.16 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives | |||||
| (1R,3R,4R,5R)-3,4-bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-5-hydroxy-1-methylcyclohexane-1-carboxylic acid | 53486249 | Click to see CC1(CC(C(C(C1)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O)C(=O)O | 514.50 | unknown | via CMAUP database |
| Caffeic acid methyl ester | 689075 | Click to see COC(=O)C=CC1=CC(=C(C=C1)O)O | 194.18 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids | |||||
| 3-(3,4-Dihydroxyphenyl)prop-2-enoate | 54710367 | Click to see C1=CC(=C(C=C1C=CC(=O)O)O)[O-] | 179.15 | unknown | via CMAUP database |
| 3,4-Dihydroxy cinnamic acid | 2518 | Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O | 180.16 | unknown | via CMAUP database |
| Caffeic Acid | 689043 | Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O | 180.16 | unknown | via CMAUP database |
| cis-Caffeic acid | 1549111 | Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O | 180.16 | unknown | via CMAUP database |
| cis-p-Coumaric acid | 1549106 | Click to see C1=CC(=CC=C1C=CC(=O)O)O | 164.16 | unknown | via CMAUP database |
| Ferulic acid | 445858 | Click to see COC1=C(C=CC(=C1)C=CC(=O)O)O | 194.18 | unknown | via CMAUP database |
| p-Coumaric acid | 637542 | Click to see C1=CC(=CC=C1C=CC(=O)O)O | 164.16 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 6,7-dihydroxycoumarins | |||||
| Esculetin | 5281416 | Click to see C1=CC(=O)OC2=CC(=C(C=C21)O)O | 178.14 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Depsides and depsidones | |||||
| (4-Ethoxycarbonyl-2,6-dihydroxyphenyl) 3,4,5-trihydroxybenzoate | 5317260 | Click to see CCOC(=O)C1=CC(=C(C(=C1)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)O | 350.28 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids | |||||
| 4'-O-Methylochnaflavone | 5384799 | Click to see COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)OC4=CC=C(C=C4)C5=CC(=O)C6=C(C=C(C=C6O5)O)O | 552.50 | unknown | via CMAUP database |
| Ochnaflavone | 5492110 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)OC4=C(C=CC(=C4)C5=CC(=O)C6=C(C=C(C=C6O5)O)O)O | 538.50 | unknown |
https://doi.org/10.3724/SP.J.1009.2010.00257 https://doi.org/10.1016/S0031-9422(00)90656-3 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins | |||||
| 2-[3,4-dihydroxy-2,5-bis(2-hydroxyethylsulfanyl)phenyl]-3,4-dihydro-2H-chromene-3,5,7-triol | 56630044 | Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3SCCO)O)O)SCCO)O | 442.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1197872/ |
| > Phenylpropanoids and polyketides / Flavonoids / Flavones | |||||
| 2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxo-4H-chromen-7-olate luteolin-7-olate(1-) | 25201972 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)[O-] | 285.23 | unknown | via CMAUP database |
| 2-[4-[4-(5,7-Dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenoxy]phenyl]-5,7-dihydroxychromen-4-one | 21574503 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)OC4=C(C=C(C=C4)C5=CC(=O)C6=C(C=C(C=C6O5)O)O)O | 538.50 | unknown | https://doi.org/10.1016/J.PHYTOCHEM.2005.10.002 |
| 2-[4-[4-(5,7-Dihydroxy-4-oxochromen-2-yl)phenoxy]-3-hydroxyphenyl]-5-hydroxy-7-methylchromen-4-one | 162923964 | Click to see CC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C=C3)OC4=CC=C(C=C4)C5=CC(=O)C6=C(C=C(C=C6O5)O)O)O)O | 536.50 | unknown | https://doi.org/10.1016/J.PHYTOCHEM.2005.10.002 |
| Apigenin | 5280443 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O | 270.24 | unknown | via CMAUP database |
| Chrysin | 5281607 | Click to see C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O | 254.24 | unknown | https://doi.org/10.1016/J.PHYTOCHEM.2005.10.002 |
| Luteolin | 5280445 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O | 286.24 | unknown |
https://doi.org/10.1016/J.PHYTOCHEM.2005.10.002 https://doi.org/10.1016/J.EJPHAR.2004.12.032 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6257122/ |
| > Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols | |||||
| Kaempferol | 5280863 | Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O | 286.24 | unknown | via CMAUP database |
| Quercetin | 5280343 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O | 302.23 | unknown | https://doi.org/10.3724/SP.J.1009.2010.00257 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides | |||||
| 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | 51402807 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O | 464.40 | unknown |
https://doi.org/10.3724/SP.J.1009.2010.00257 https://doi.org/10.1017/S0890037X0003027X |
| 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl D-galactopyranoside | 11751616 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O | 464.40 | unknown | via CMAUP database |
| 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one | 20055286 | Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O | 594.50 | unknown | via CMAUP database |
| 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[(2S,4R,5S)-3,4,5-trihydroxy-6-[[(2R,4R,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one | 24211973 | Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O | 594.50 | unknown | via CMAUP database |
| 5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one | 12313332 | Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O | 594.50 | unknown | via CMAUP database |
| Astragalin | 5282102 | Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O | 448.40 | unknown | https://doi.org/10.3724/SP.J.1009.2010.00257 |
| Hyperoside | 5281643 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O | 464.40 | unknown | https://doi.org/10.1017/S0890037X0003027X |
| Isoquercetin | 5280804 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O | 464.40 | unknown | via CMAUP database |
| Isoquercitrin | 5484006 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(O4)C(CO)O)O)O)O)O | 464.40 | unknown | https://doi.org/10.1016/J.JPBA.2008.09.037 |
| Kaempferol-3-O-rutinoside | 5318767 | Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O | 594.50 | unknown | via CMAUP database |
| Quercitrin | 5280459 | Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O | 448.40 | unknown | via CMAUP database |
| Rutin | 5280805 | Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O | 610.50 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides | |||||
| 5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | 44257792 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O | 432.40 | unknown | via CMAUP database |
| 7-{[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-4H-chromen-4-one | 16724248 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC4=C(C=C3)C(=O)C=C(O4)C5=CC(=C(C=C5)O)O)CO)O)O)O)O)O | 578.50 | unknown | via CMAUP database |
| Apigenin 7-O-glucoside | 5385553 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O | 432.40 | unknown | via CMAUP database |
| Apigenin-7-O-Glucoside | 12304093 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O | 432.40 | unknown | via CMAUP database |
| Apigetrin | 5280704 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O | 432.40 | unknown | via CMAUP database |
| Luteolin 7-galactoside | 5291488 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O | 448.40 | unknown | via CMAUP database |
| Luteolin 7-O-glucoside | 5280637 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O | 448.40 | unknown | https://doi.org/10.1017/S0890037X0003027X |
| Rhoifolin | 5282150 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)O)O)CO)O)O)O)O)O | 578.50 | unknown | https://doi.org/10.3724/SP.J.1009.2010.00257 |
| Scolymoside | 5282152 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC(=C(C=C5)O)O)O)CO)O)O)O)O)O | 594.50 | unknown | https://doi.org/10.1016/J.FITOTE.2006.04.011 |
| > Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 3-O-methylated flavonoids | |||||
| 2-[4-[4-(5,7-Dihydroxy-4-oxochromen-2-yl)-2-methoxyphenoxy]phenyl]-5,7-dihydroxychromen-4-one | 21574502 | Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)OC4=CC=C(C=C4)C5=CC(=O)C6=C(C=C(C=C6O5)O)O | 552.50 | unknown | https://doi.org/10.1016/J.PHYTOCHEM.2005.10.002 |
| 4',5-Dihydroxy-3'-methoxyflavon-7-olate(1-) | 25203524 | Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)[O-] | 299.25 | unknown | via CMAUP database |
| Chryseriol | 5280666 | Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O | 300.26 | unknown | via CMAUP database |
| Tricin | 5281702 | Click to see COC1=CC(=CC(=C1O)OC)C2=CC(=O)C3=C(C=C(C=C3O2)O)O | 330.29 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Isoflavonoids / O-methylated isoflavonoids / 4-O-methylated isoflavonoids | |||||
| (3S)-3,5,7-trihydroxy-3-(2-hydroxy-4-methoxyphenyl)-2H-chromen-4-one | 44446903 | Click to see COC1=CC(=C(C=C1)C2(COC3=CC(=CC(=C3C2=O)O)O)O)O | 318.28 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Macrolides and analogues | |||||
| Oxacyclohexadecan-2-one | 235414 | Click to see C1CCCCCCCOC(=O)CCCCCC1 | 240.38 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6270114/ |
| > Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins | |||||
| 3-ethenyl-4-[2-[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoyl]oxyethyl]-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-5-carboxylic acid | 85376844 | Click to see COC1=C(C=CC(=C1)C(=O)OCCC2C(C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)C=C)OC4C(C(C(C(O4)CO)O)O)O | 688.60 | unknown | https://doi.org/10.1248/CPB.50.1041 |
| 4-[(2S,3R,4S,5S,6R)-6-(benzoyloxymethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-3-methoxybenzoic acid | 76328130 | Click to see COC1=C(C=CC(=C1)C(=O)O)OC2C(C(C(C(O2)COC(=O)C3=CC=CC=C3)O)O)O | 434.40 | unknown | via CMAUP database |
| 7-O-(4-beta-D-glucopyranosyloxy-3-methoxybenzoyl)secologanolic acid | 11039732 | Click to see COC1=C(C=CC(=C1)C(=O)OCCC2C(C(OC=C2C(=O)O)OC3C(C(C(C(O3)CO)O)O)O)C=C)OC4C(C(C(C(O4)CO)O)O)O | 688.60 | unknown | https://doi.org/10.1248/CPB.50.1041 |
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