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Nelumbo nucifera

Nelumbo nucifera - Unknown
Part: Unknown
Author: Public Domain - WikiMedia
Nelumbo nucifera - Unknown
Part: Unknown
Author: Public Domain - WikiMedia
Nelumbo nucifera - Unknown
Part: Unknown
Author: Public Domain - WikiMedia
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Table of Contents

Details
Description
Synonyms
Common Names
Subtypes (subspecies, varieties, subvarieties, forms)
Germination/Propagation
Distribution
Links to other databases
Genome
Scientific Literature
Phytochemical Profile
Biological Material
Contributors
Collections

Details Top

Internal ID UUID643ff680088fe640386957
Scientific name Nelumbo nucifera
Authority Gaertn.
First published in Fruct. Sem. Pl. 1: 73 (1788)

Description Top

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No description added yet. Help us by writing one.

Synonyms Top

Scientific name Authority First published in
Nymphaea nelumbo L. Sp. Pl. : 511 (1753)
Nelumbium javanicum Poir. Encycl. 2: 454 (1788)
Nelumbium indicum Poir. Encycl. 4: 453 (1798)
Nelumbium caspium Eichw. Pl. Nov. Casp.-Cauc. : 2 (1831)
Nelumbium asiaticum Rich. Ann. Mus. Hist. Nat. 17: 249 (1811)
Nelumbium album Bercht. & J.Presl Prir. Rostlin 1(Nelumb.): 2 (1823)
Nelumbium transversum C.Presl Reliq. Haenk. 2: 83 (1835)
Nelumbo komarovii Grossh. Bot. Mater. Gerb. Bot. Inst. Komarova Akad. Nauk S.S.S.R. 8: 135 (1940)
Nelumbo indica Pers. Syn. Pl. 2: 92 (1806)
Nelumbo caspica Schipcz. Trudy Bot. Sada Akad. Nauk S.S.S.R. 43: 314 (1930)
Nelumbium turbinatum Blanco Fl. Filip. : 458 (1837)
Nelumbium nelumbo Druce Rep. Bot. Exch. Club Soc. Brit. Isles 3: 421 (1913 publ. 1914)
Nelumbium tamara Sweet Hort. Brit. : 14 (1826)
Nelumbium speciosum Willd. Sp. Pl., ed. 4 , 2: 1258 (1799)
Nelumbium rheedei C.Presl Reliq. Haenk. 2: 83 (1835)
Nelumbo speciosa var. alba F.M.Bailey Cat. Pl. Brisbane : 5 (1885)
Tamara hemisphaerica Buch.-Ham. ex Pritz. Icon. Bot. Index : 1087 (1855)
Nelumbo speciosa Willd. Sp. Pl., ed. 4 [Willdenow] 2(2):1258. 1799 (as Nelumbium speciosum)
Nelumbo caspica Fisch.
Nelumbo nucifera var. macrorhizomata Nakai

Common names Top

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Language Common/alternative name
English sacred lotus
English lotus
English east indian lotus
English lotus flower
English bean of india
English indian lotus
English pudma
Spanish loto indio
Spanish loto sagrado
Spanish rosa del nilo
Arabic اللوتس المقدس
Arabic نيلم جوزي
Arabic الفول المصري
Arabic الدر الري
Arabic الضال
Arabic باقلي قبطي
Arabic جامسة
Assamese পদুম
Azerbaijani fındıqcalı şanagüllə
bcl lotus
Bulgarian Свещен лотос
Bulgarian Индийски лотос
bho कमल
bjn seroja
Bengali কমল
Bengali পদ্ম
Bosnian lotos
bxr Бадма сэсэг
Catalan lotus de l'Índia
cdo lèng-huă
Czech lotos ořechonosný
German nelumbium speciosum
German nymphaea nelumbo
German indischer lotos
German indische lotosblume
dty कमल (फूल )
dv ނެލަންބޯ ނުސިފޭރާ
Greek ινδικός λωτός
Esperanto hinda lotuso
Basque loto
Basque indiako loto
Basque indiar loto
Basque loto sakratu
Persian لاله مردابی
Finnish intianlootus
French fève d'Égypte
French lotus d'orient
French lotus de l'inde
French lotus des indes
French lotus magnolia
French racine de lotus
French lotus sacré
Galician loto sagrado
gom साळीक
Gujarati કમળ
Hebrew לוטוס
Hindi कमल
Croatian lotos
Hungarian indiai lótusz
Indonesian seroja
Icelandic vatnalilja
Japanese ハス
jv seroja
Kazakh Үндістан лотосы
Khmer ឈូក
Kannada ಕಮಲ
Korean 연꽃
ks پَمپوش
lb indesche lotus
Lithuanian riešutinis lotosas
Latvian riekstu lotoss
lzh 蓮
mai कमल
mdf Индиянь лотос
Macedonian лотос
Macedonian оревоносен лотос
Macedonian индиски лотос
Malayalam താമര
mn Цацаргин
Marathi कमळ
Burmese ပဒုမ္မာကြာ
Norwegian Bokmål lotusrot
Nepali कमल
new पलेस्वां
Dutch indische lotus
Dutch heilige lotus
Norwegian Nynorsk lotus
Oriya ପଦ୍ମ ଫୁଲ
Punjabi ਕਮਲ
pam tukal
Polish lotos orzechodajny
Punjab کنول
Russian лотос орехоносный
Kinyarwanda lotusi y’ubuhinde
sa कमलम्
Serbo-Croatian lotos
Sinhala නෙළුම්
Slovak lotos indický
Slovenian indijski lotos
su saroja
Swedish indisk lotus
szy nipaluma-kalapa
Tamil தாமரை
Telugu తామర పువ్వు
tg Гули садра
Thai บัวหลวง
Turkish hint lotusu
Ukrainian Індійський лотос
Urdu کنول
Vietnamese sen hồng
za va'ngaeux
Chinese 荷叶
Chinese 莲花
Chinese 荷花
Chinese 荷
Chinese 莲
Chinese 蓮
Chinese 芙蓉
Chinese 藕
Chinese 石莲子
Chinese 荷叶蒂
Chinese 荷梗
Chinese 荷蒂
Chinese 莲子
Chinese 莲子心
Chinese 莲房
Chinese 莲藕
Chinese 莲衣
Chinese 莲须
Chinese 藕节
Chinese 芙蕖
Chinese 菡萏
Chinese 蓮花
Chinese 白莲
Chinese 蓮華

Subspecies (abbr. subsp./ssp.) Top

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Varieties (abbr. var.) Top

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Subvarieties (abbr. subvar.) Top

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Forms (abbr. f.) Top

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No forms added yet.

Germination/Propagation Top

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No germination or propagation data was added yet.

Distribution (via POWO/KEW) Top

Legend for the distribution data:
- Doubtful data
- Extinct
- Introduced
- Native
  • Asia-temperate
    • Caucasus
      • North Caucasus
      • Transcaucasus
    • China
      • China North-central
      • China South-central
      • China Southeast
      • Hainan
      • Manchuria
    • Eastern Asia
      • Japan
      • Korea
    • Russian Far East
      • Amur
      • Khabarovsk
      • Primorye
    • Western Asia
      • Iran
  • Asia-tropical
    • Indian Subcontinent
      • Assam
      • Bangladesh
      • East Himalaya
      • India
      • Nepal
      • Pakistan
      • Sri Lanka
      • West Himalaya
    • Indo-China
      • Cambodia
      • Laos
      • Myanmar
      • Thailand
      • Vietnam
    • Malesia
      • Jawa
      • Lesser Sunda Islands
      • Malaya
      • Philippines
    • Papuasia
      • New Guinea
  • Australasia
    • Australia
      • Northern Territory
      • Queensland
      • Western Australia
  • Europe
    • Eastern Europe
      • South European Russia
      • Ukraine
    • Southeastern Europe
      • Italy
      • Romania
  • Northern America
    • North-central U.S.A.
      • Missouri
    • Northeastern U.S.A.
      • Massachusetts
      • New Jersey
      • West Virginia
    • South-central U.S.A.
      • Texas
    • Southeastern U.S.A.
      • Alabama
      • Arkansas
      • Florida
      • Georgia
      • Kentucky
      • Louisiana
      • Mississippi
      • North Carolina
      • South Carolina
      • Tennessee
  • Pacific
    • South-central Pacific
      • Cook Islands
    • Southwestern Pacific
      • Vanuatu
  • Southern America
    • Caribbean
      • Cuba
      • Leeward Islands
      • Puerto Rico
      • Trinidad-Tobago
      • Windward Islands

Links to other databases Top

Suggest others/fix!
Database ID/link to page
World Flora Online wfo-0000382378
UNII 622D93A1R1
Florida Plant Atlas 1902
Flora of Alabama 2693
Canadensys 28811
USDA Plants NENU2
Tropicos 22600041
INPN 447414
Flora of Italy 984
KEW urn:lsid:ipni.org:names:605422-1
The Plant List kew-2384945
Plantarium 46831
Missouri Botanical Garden 282911
PFAF Nelumbo nucifera
Open Tree Of Life 532288
Observations.org 135964
NCBI Taxonomy 4432
Nature Serve 2.138373
IPNI 605422-1
iNaturalist 82814
GBIF 2882449
Freebase /m/03_mtn
EPPO NELNU
EOL 596454
Elurikkus 5860
USDA GRIN 25110
Wikipedia Nelumbo_nucifera
CMAUP NPO3478
PaleoBotany 82082

Genomes (via NCBI) Top

Below is displayed the reference genome only!
If you wish to browse all genomes for this plant click here.
Accession Assembly
Name Level Submitter Released Coverage Size
GCF_000365185.1 Chinese Lotus 1.1 Scaffold University of Illinois at Urbana-Champaign 2013-08-08 100.0x 767.22 Mb

Scientific Literature Top

Below are displayed the latest 15 articles published in PMC (PubMed Central®) and other sources (DOI number only)!
If you wish to see all the related articles click here.
Title Authors Publication Released IDs
Phylogenomic profiles of whole-genome duplications in Poaceae and landscape of differential duplicate retention and losses among major Poaceae lineages Zhang T, Huang W, Zhang L, Li DZ, Qi J, Ma H Nat Commun 17-Apr-2024
PMCID:PMC11024178
doi:10.1038/s41467-024-47428-9
PMID:38632270
Integrated transcriptomic and WGCNA analyses reveal candidate genes regulating mainly flavonoid biosynthesis in Litsea coreana var. sinensis Xie N, Guo Q, Li H, Yuan G, Gui Q, Xiao Y, Liao M, Yang L BMC Plant Biol 01-Apr-2024
PMCID:PMC10985888
doi:10.1186/s12870-024-04949-1
PMID:38561656
Advancements in research on the immune-inflammatory mechanisms mediated by NLRP3 inflammasome in ischemic stroke and the regulatory role of natural plant products Yang K, Zeng L, He Q, Wang S, Xu H, Ge J Front Pharmacol 27-Mar-2024
PMCID:PMC11004298
doi:10.3389/fphar.2024.1250918
PMID:38601463
Identification and Expression Analysis of Putative Sugar Transporter Gene Family during Bulb Formation in Lilies Huang Z, Gao C, Xu Y, Liu J, Kang J, Ren Z, Cui Q, Li D, Ma S, Xia Y, Wu Y Int J Mol Sci 20-Mar-2024
PMCID:PMC10970775
doi:10.3390/ijms25063483
PMID:38542476
Local knowledge of homegarden plants in Miao ethnic communities in Laershan region, Xiangxi area, China Luo J, Li Q, He J, Yan J, Zhang S, Chang X, Wu T J Ethnobiol Ethnomed 18-Mar-2024
PMCID:PMC10946099
doi:10.1186/s13002-024-00676-x
PMID:38500123
Hypoglycemic activity in vivo and in vitro of the Lotus (Nelumbo nucifera Gaertn.) seed skin (testa) phenolic-rich extracts Xu H, Wang C, Gong L Food Chem X 16-Mar-2024
PMCID:PMC10972837
doi:10.1016/j.fochx.2024.101282
PMID:38550890
Therapeutic potential of Thai herbal formula for cognitive impairment: A metabolomics approach for Comprehensive Insights Akarasereenont P, Pattanapholkornsakul S, Limsuvan S, Mamaethong D, Booranasubkajorn S, Pakaprot N, Tripatara P, Pilakasiri K Heliyon 16-Mar-2024
PMCID:PMC10981045
doi:10.1016/j.heliyon.2024.e28027
PMID:38560220
Nature-Inspired Superhydrophobic Coating Materials: Drawing Inspiration from Nature for Enhanced Functionality Barthwal S, Uniyal S, Barthwal S Micromachines (Basel) 13-Mar-2024
PMCID:PMC10972411
doi:10.3390/mi15030391
PMID:38542636
The Potential Role of Major Argan Oil Compounds as Nrf2 Regulators and Their Antioxidant Effects El Kebbaj R, Bouchab H, Tahri-Joutey M, Rabbaa S, Limami Y, Nasser B, Egbujor MC, Tucci P, Andreoletti P, Saso L, Cherkaoui-Malki M Antioxidants (Basel) 13-Mar-2024
PMCID:PMC10967919
doi:10.3390/antiox13030344
PMID:38539877
Integration of network pharmacology and experimental verifications reveals the Bian-Se-Tong mixture can alleviate constipation in STC rats by reducing apoptosis of Cajal cells via activating PI3K-Akt signaling pathway Wu R, Zhang Z, Xu Q, Liu F, Zhan Y, Wang Q, Du L, Tang X Heliyon 13-Mar-2024
PMCID:PMC10998068
doi:10.1016/j.heliyon.2024.e28022
PMID:38586320
ABA Inhibits Rice Seed Aging by Reducing H2O2 Accumulation in the Radicle of Seeds Zheng Q, Teng Z, Zhang J, Ye N Plants (Basel) 12-Mar-2024
PMCID:PMC10976155
doi:10.3390/plants13060809
PMID:38592812
In Silico Analysis of Glutamate Receptors in Capsicum chinense: Structure, Evolution, and Molecular Interactions León-García F, García-Laynes F, Estrada-Tapia G, Monforte-González M, Martínez-Estevez M, Echevarría-Machado I Plants (Basel) 12-Mar-2024
PMCID:PMC10975470
doi:10.3390/plants13060812
PMID:38592787
Flavonoids: A treasure house of prospective pharmacological potentials Hasnat H, Shompa SA, Islam MM, Alam S, Richi FT, Emon NU, Ashrafi S, Ahmed NU, Chowdhury MN, Fatema N, Hossain MS, Ghosh A, Ahmed F Heliyon 09-Mar-2024
PMCID:PMC10944245
doi:10.1016/j.heliyon.2024.e27533
PMID:38496846
Flavonoids as Insecticides in Crop Protection—A Review of Current Research and Future Prospects Pereira V, Figueira O, Castilho PC Plants (Basel) 08-Mar-2024
PMCID:PMC10975847
doi:10.3390/plants13060776
PMID:38592833
A multi-center cross-sectional study of Chinese Herbal Medicine-Drug adverse reactions using active surveillance in Singapore’s Traditional Chinese Medicine clinics Ng CY, Zhao Y, Wang N, Chia KL, Teo CH, Peh W, Yeo P, Zhong LL Chin Med 07-Mar-2024
PMCID:PMC10918936
doi:10.1186/s13020-024-00915-z
PMID:38454483

Phytochemical Profile Top

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Below are displayed the proven (via scientific papers) natural compounds!
You can also contribute to this by clicking here.
Name PubChem ID Canonical SMILES MW Found in Proof
> Alkaloids and derivatives / Aporphines
(-)-Caaverine 23335 Click to see COC1=C(C2=C3C(CC4=CC=CC=C42)NCCC3=C1)O 267.32 unknown https://doi.org/10.1007/S10600-011-9919-Z
(-)-Lirinidine 821343 Click to see CN1CCC2=CC(=C(C3=C2C1CC4=CC=CC=C43)O)OC 281.30 unknown via CMAUP database
(-)-N-nornuciferine 624491 Click to see COC1=C(C2=C3C(CC4=CC=CC=C42)NCCC3=C1)OC 281.30 unknown https://doi.org/10.1248/YAKUSHI1947.90.9_1165
https://doi.org/10.1007/S10600-011-9919-Z
(+)-1,2-Methylenedioxy-5,6,6aalpha,7-tetrahydro-4H-dibenzo[de,g]quinoline 26202781 Click to see C1CNC2CC3=CC=CC=C3C4=C2C1=CC5=C4OCO5 265.31 unknown https://doi.org/10.1248/YAKUSHI1947.90.9_1165
(+)-Asimilobine 25774982 Click to see COC1=C(C=C2CCNC3C2=C1C4=CC=CC=C4C3)O 267.32 unknown https://doi.org/10.1021/NP50052A044
(6aR)-1-methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline 144240682 Click to see CN1CCC2=C3C1CC4=CC=CC=C4C3=C(C=C2)OC 265.30 unknown https://doi.org/10.1248/YAKUSHI1947.82.10_1458
(R)-1-Methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-2-ol 91746555 Click to see CN1CCC2=CC(=C(C3=C2C1CC4=CC=CC=C43)OC)O 281.30 unknown via CMAUP database
(R)-6-Methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline 10421583 Click to see CN1CCC2=C3C1CC4=CC=CC=C4C3=CC=C2 235.32 unknown via CMAUP database
(R)-Asimilobine 12308663 Click to see COC1=C(C=C2CCNC3C2=C1C4=CC=CC=C4C3)O 267.32 unknown https://doi.org/10.1007/S10600-011-9919-Z
(R)-Roemerine 235224 Click to see CN1CCC2=CC3=C(C4=C2C1CC5=CC=CC=C54)OCO3 279.30 unknown https://doi.org/10.1007/S10600-011-9919-Z
https://doi.org/10.1016/J.JEP.2005.09.025
https://doi.org/10.1248/YAKUSHI1947.82.10_1458
https://doi.org/10.1021/NP50052A044
https://doi.org/10.1248/YAKUSHI1947.90.9_1165
1-Hydroxy-2-methoxynoraporphine 3467443 Click to see COC1=C(C2=C3C(CC4=CC=CC=C42)NCCC3=C1)O 267.32 unknown https://doi.org/10.1007/S10600-011-9919-Z
1-methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline 20556263 Click to see CN1CCC2=C3C1CC4=CC=CC=C4C3=C(C=C2)OC 265.30 unknown https://doi.org/10.1248/YAKUSHI1947.82.10_1458
1,2-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-10-ol 3380329 Click to see CN1CCC2=CC(=C(C3=C2C1CC4=C3C=C(C=C4)O)OC)OC 311.40 unknown via CMAUP database
1,2-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline 3108374 Click to see CN1CCC2=CC(=C(C3=C2C1CC4=CC=CC=C43)OC)OC 295.40 unknown https://doi.org/10.1248/YAKUSHI1947.90.9_1165
https://doi.org/10.1007/S10600-011-9919-Z
https://doi.org/10.1248/YAKUSHI1947.86.1_75
1,2-Methylenedioxynoraporphine 3462225 Click to see C1CNC2CC3=CC=CC=C3C4=C2C1=CC5=C4OCO5 265.31 unknown https://doi.org/10.1007/S10600-011-9919-Z
https://doi.org/10.1248/YAKUSHI1947.90.9_1165
15,16-Dimethoxy-10-methyl-10-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,8,13,15-heptaen-8-ol 122210734 Click to see CN1CCC2=CC(=C(C3=C2C1=C(C4=CC=CC=C43)O)OC)OC 309.40 unknown https://doi.org/10.1007/S10600-011-9919-Z
2-Hydroxy-1-methoxy-6a,7-dehydroaporphine 46203429 Click to see CN1CCC2=CC(=C(C3=C2C1=CC4=CC=CC=C43)OC)O 279.30 unknown via CMAUP database
2-Methoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline 71716168 Click to see CN1CCC2=C3C1CC4=CC=CC=C4C3=CC(=C2)OC 265.30 unknown via CMAUP database
5H-Benzo[g]-1,3-benzodioxolo[6,5,4-de]quinolin-11-ol, 6,7,7a,8-tetrahydro-7-methyl-, (7aR)- 5274588 Click to see CN1CCC2=CC3=C(C4=C2C1CC5=C4C=C(C=C5)O)OCO3 295.30 unknown via CMAUP database
Anonaine 160597 Click to see C1CNC2CC3=CC=CC=C3C4=C2C1=CC5=C4OCO5 265.31 unknown https://doi.org/10.1021/NP50052A044
https://doi.org/10.1007/S10600-011-9919-Z
Aporeine 800239 Click to see CN1CCC2=CC3=C(C4=C2C1CC5=CC=CC=C54)OCO3 279.30 unknown via CMAUP database
Asimilobine 160875 Click to see COC1=C(C=C2CCNC3C2=C1C4=CC=CC=C4C3)O 267.32 unknown https://doi.org/10.1007/S10600-011-9919-Z
https://doi.org/10.1021/NP50052A044
Dehydroaporheine 161899 Click to see CN1CCC2=CC3=C(C4=C2C1=CC5=CC=CC=C54)OCO3 277.30 unknown https://doi.org/10.1016/S0031-9422(00)84467-2
Dehydronuciferine 821347 Click to see CN1CCC2=CC(=C(C3=C2C1=CC4=CC=CC=C43)OC)OC 293.40 unknown via CMAUP database
Floribundine 5319512 Click to see CN1CCC2=CC(=C(C3=C2C1CC4=CC=CC=C43)OC)O 281.30 unknown https://doi.org/10.1248/YAKUSHI1947.90.9_1165
https://doi.org/10.1007/S10600-011-9919-Z
https://doi.org/10.1021/NP50052A044
Lirinidine 31069 Click to see CN1CCC2=CC(=C(C3=C2C1CC4=CC=CC=C43)O)OC 281.30 unknown https://doi.org/10.1021/NP50052A044
Liriodenine 10144 Click to see C1OC2=C(O1)C3=C4C(=C2)C=CN=C4C(=O)C5=CC=CC=C53 275.26 unknown https://doi.org/10.1021/NP50052A044
https://doi.org/10.1007/S10600-011-9919-Z
https://doi.org/10.1016/J.BMCL.2013.04.013
Lysicamine 122691 Click to see COC1=C(C2=C3C(=C1)C=CN=C3C(=O)C4=CC=CC=C42)OC 291.30 unknown https://doi.org/10.1007/S10600-011-9919-Z
N-Nornuciferine 12313579 Click to see COC1=C(C2=C3C(CC4=CC=CC=C42)NCCC3=C1)OC 281.30 unknown https://doi.org/10.1248/YAKUSHI1947.90.9_1165
https://doi.org/10.1007/S10600-011-9919-Z
Nornuciferine 41169 Click to see COC1=C(C2=C3C(CC4=CC=CC=C42)NCCC3=C1)OC 281.30 unknown https://doi.org/10.1016/S1674-6384(14)60051-4
https://doi.org/10.1021/NP50052A044
Nuciferine 10146 Click to see CN1CCC2=CC(=C(C3=C2C1CC4=CC=CC=C43)OC)OC 295.40 unknown https://doi.org/10.1248/YAKUSHI1947.90.9_1165
https://doi.org/10.1007/S10600-011-9919-Z
https://doi.org/10.1248/YAKUSHI1947.86.1_75
https://doi.org/10.1016/S1674-6384(14)60051-4
https://doi.org/10.1021/JF501644T
https://doi.org/10.1021/NP50052A044
Nuciferine N-Oxide 71720427 Click to see C[N+]1(CCC2=CC(=C(C3=C2C1CC4=CC=CC=C43)OC)OC)[O-] 311.40 unknown via CMAUP database
O-Nornuciferine 197017 Click to see CN1CCC2=CC(=C(C3=C2C1CC4=CC=CC=C43)OC)O 281.30 unknown https://doi.org/10.1248/YAKUSHI1947.90.9_1165
https://doi.org/10.1007/S10600-011-9919-Z
https://doi.org/10.1021/NP50052A044
Roemerine 119204 Click to see CN1CCC2=CC3=C(C4=C2C1CC5=CC=CC=C54)OCO3 279.30 unknown https://doi.org/10.1007/S10600-011-9919-Z
https://doi.org/10.1248/YAKUSHI1947.82.10_1458
https://doi.org/10.1021/NP50052A044
https://doi.org/10.1248/YAKUSHI1947.90.9_1165
> Alkaloids and derivatives / Aporphines / 4,5-dioxoaporphines
Cepharadione B 189151 Click to see CN1C2=CC3=CC=CC=C3C4=C2C(=CC(=C4OC)OC)C(=O)C1=O 321.30 unknown https://doi.org/10.1007/S10600-011-9919-Z
> Alkaloids and derivatives / Aporphines / Hydroxy-7-aporphines
Nornuciferidine 183520 Click to see COC1=C(C2=C3C(C(C4=CC=CC=C42)O)NCCC3=C1)OC 297.30 unknown via CMAUP database
> Alkaloids and derivatives / Morphinans
(1S,9S,10R)-3-hydroxy-4,13-dimethoxy-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5,13-tetraen-12-one 11667062 Click to see CN1CCC23C=C(C(=O)CC2C1CC4=C3C(=C(C=C4)OC)O)OC 329.40 unknown via CMAUP database
> Alkaloids and derivatives / Plumeran-type alkaloids
methyl (4S)-4-[(10S,11R)-11-acetyloxy-12-ethyl-10-hydroxy-5-methoxy-10-methoxycarbonyl-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraen-4-yl]-1-ethyl-2-oxa-6,16-diazahexacyclo[16.2.1.03,19.05,13.07,12.016,19]henicosa-5(13),7,9,11-tetraene-4-carboxylate 5315743 Click to see CCC12CC3CN4C3(C1)C(O2)C(C5=C(CC4)C6=CC=CC=C6N5)(C7=C(C=C8C(=C7)C91CCN2C9C(C=CC2)(C(C(C1N8C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC 821.00 unknown via CMAUP database
> Alkaloids and derivatives / Proaporphines
(+)-Pronuciferine 200480 Click to see CN1CCC2=CC(=C(C3=C2C1CC34C=CC(=O)C=C4)OC)OC 311.40 unknown https://doi.org/10.1016/J.BMCL.2013.04.013
https://doi.org/10.1248/YAKUSHI1947.86.1_75
https://doi.org/10.1248/YAKUSHI1947.90.9_1165
https://doi.org/10.1016/J.PHYMED.2008.09.005
https://doi.org/10.1016/J.JEP.2005.09.025
(R)-Pronuciferine 628376 Click to see CN1CCC2=CC(=C(C3=C2C1CC34C=CC(=O)C=C4)OC)OC 311.40 unknown https://doi.org/10.1248/YAKUSHI1947.90.9_1165
https://doi.org/10.1248/YAKUSHI1947.86.1_75
Pronuciferine, (-)- 793841 Click to see CN1CCC2=CC(=C(C3=C2C1CC34C=CC(=O)C=C4)OC)OC 311.40 unknown via CMAUP database
> Benzenoids / Anthracenes
Anthracene 8418 Click to see C1=CC=C2C=C3C=CC=CC3=CC2=C1 178.23 unknown via CMAUP database
> Benzenoids / Anthracenes / Anthraquinones / Hydroxyanthraquinones
2-Hydroxychrysophanol 442759 Click to see CC1=CC2=C(C(=C1O)O)C(=O)C3=C(C2=O)C=CC=C3O 270.24 unknown via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters
4-Fluorobenzoic acid, tridec-2-ynyl ester 530964 Click to see CCCCCCCCCCC#CCOC(=O)C1=CC=C(C=C1)F 318.40 unknown via CMAUP database
Dibutyl Phthalate 3026 Click to see CCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC 278.34 unknown via CMAUP database
Diisobutyl phthalate 6782 Click to see CC(C)COC(=O)C1=CC=CC=C1C(=O)OCC(C)C 278.34 unknown via CMAUP database
Diisooctyl phthalate 33934 Click to see CC(C)CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC(C)C 390.60 unknown via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters / o-Hydroxybenzoic acid esters
Benzoic acid, 2-hydroxy-6-pentadecyl-, methyl ester 10546625 Click to see CCCCCCCCCCCCCCCC1=C(C(=CC=C1)O)C(=O)OC 362.50 unknown via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acids
4-Hydroxybenzoate 54675830 Click to see C1=CC(=CC=C1C(=O)O)[O-] 137.11 unknown via CMAUP database
> 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
4-Hydroxybenzoic acid 135 Click to see C1=CC(=CC=C1C(=O)O)O 138.12 unknown https://doi.org/10.1248/BPB.33.267
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives
Syringic acid 10742 Click to see COC1=CC(=CC(=C1O)OC)C(=O)O 198.17 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
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 / P-methoxybenzoic acids and derivatives
p-Anisic acid 7478 Click to see COC1=CC=C(C=C1)C(=O)O 152.15 unknown https://doi.org/10.1248/CPB.59.947
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Salicylic acid and derivatives / Salicylic acids
Anacardic acid 167551 Click to see CCCCCCCCCCCCCCCC1=C(C(=CC=C1)O)C(=O)O 348.50 unknown via CMAUP database
Ginkgolic acid 5281858 Click to see CCCCCCC=CCCCCCCCC1=C(C(=CC=C1)O)C(=O)O 346.50 unknown via CMAUP database
Salicylic Acid 338 Click to see C1=CC=C(C(=C1)C(=O)O)O 138.12 unknown via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Phenylpropanes
2,4-Di-tert-butylphenol 7311 Click to see CC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)C 206.32 unknown via CMAUP database
> Benzenoids / Naphthalenes
1,1,6-Trimethyl-1,2-dihydronaphthalene 121677 Click to see CC1=CC2=C(C=C1)C(CC=C2)(C)C 172.27 unknown via CMAUP database
Naphthalene 931 Click to see C1=CC=C2C=CC=CC2=C1 128.17 unknown via CMAUP database
> Benzenoids / Phenol ethers
CARBAMIC ACID, (METHOXYACETYL)METHYL-, o-ISOPROPOXYPHENYL ESTER 28848 Click to see CC(C)OC1=CC=CC=C1OC(=O)NCC(=O)COC 281.30 unknown via CMAUP database
> Benzenoids / Phenol ethers / Anisoles
4-Methoxystyrene 12507 Click to see COC1=CC=C(C=C1)C=C 134.17 unknown via CMAUP database
alpha-Asarone 636822 Click to see CC=CC1=CC(=C(C=C1OC)OC)OC 208.25 unknown via CMAUP database
beta-Asarone 5281758 Click to see CC=CC1=CC(=C(C=C1OC)OC)OC 208.25 unknown via CMAUP database
> Benzenoids / Phenols / Benzenediols / Catechols
Catechol 289 Click to see C1=CC=C(C(=C1)O)O 110.11 unknown via CMAUP database
Catechol,[14c(u)] 11480435 Click to see C1=CC=C(C(=C1)O)O 122.07 unknown via CMAUP database
> Benzenoids / Phenols / Methoxyphenols
N-Trans-feruloyltramine 5280537 Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)O 313.30 unknown https://doi.org/10.1016/J.BMCL.2013.04.013
> Hydrocarbons / Saturated hydrocarbons / Alkanes
Eicosane 8222 Click to see CCCCCCCCCCCCCCCCCCCC 282.50 unknown via CMAUP database
Heneicosane 12403 Click to see CCCCCCCCCCCCCCCCCCCCC 296.60 unknown via CMAUP database
Heptadecane 12398 Click to see CCCCCCCCCCCCCCCCC 240.50 unknown via CMAUP database
Nonadecane 12401 Click to see CCCCCCCCCCCCCCCCCCC 268.50 unknown https://doi.org/10.5650/JOS1956.32.48
Octadecane 11635 Click to see CCCCCCCCCCCCCCCCCC 254.50 unknown via CMAUP database
Pentadecane 12391 Click to see CCCCCCCCCCCCCCC 212.41 unknown via CMAUP database
Tetracontane 20149 Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC 563.10 unknown via CMAUP database
Tetradecane 12389 Click to see CCCCCCCCCCCCCC 198.39 unknown https://doi.org/10.1080/10412905.1991.9697932
> Hydrocarbons / Saturated hydrocarbons / Alkanes / Branched alkanes
5,6-Dipropyldecane 518459 Click to see CCCCC(CCC)C(CCC)CCCC 226.44 unknown via CMAUP database
> Hydrocarbons / Unsaturated hydrocarbons / Unsaturated aliphatic hydrocarbons
1-Heptadecene 23217 Click to see CCCCCCCCCCCCCCCC=C 238.50 unknown https://doi.org/10.1080/10412905.1991.9697932
1-Pentadecene 25913 Click to see CCCCCCCCCCCCCC=C 210.40 unknown https://doi.org/10.1080/10412905.1991.9697932
> Lignans, neolignans and related compounds
Repandine 10031631 Click to see CN1CCC2=CC(=C(C3=C2C1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)CC6C7=CC(=C(C=C7CCN6C)OC)O3)O)OC)OC 608.70 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters
Ethyl 9-hexadecenoate 5364759 Click to see CCCCCCC=CCCCCCCCC(=O)OCC 282.50 unknown via CMAUP database
Ethyl arachidonate 5367369 Click to see CCCCCC=CCC=CCC=CCC=CCCCC(=O)OCC 332.50 unknown via CMAUP database
Ethyl palmitate 12366 Click to see CCCCCCCCCCCCCCCC(=O)OCC 284.50 unknown via CMAUP database
Ethyl tetradecanoate 31283 Click to see CCCCCCCCCCCCCC(=O)OCC 256.42 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Fatty acid methyl esters
Methyl eicosa-5,8,11,14,17-pentaenoate 5367433 Click to see CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OC 316.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
(Z)-9,10-dideuteriooctadec-9-enoic acid 13011408 Click to see CCCCCCCCC=CCCCCCCCC(=O)O 284.50 unknown via CMAUP database
14-Bromopentadecanoic acid 543912 Click to see CC(CCCCCCCCCCCCC(=O)O)Br 321.29 unknown via CMAUP database
Arachidic Acid 10467 Click to see CCCCCCCCCCCCCCCCCCCC(=O)O 312.50 unknown via CMAUP database
Elaidic Acid 637517 Click to see CCCCCCCCC=CCCCCCCCC(=O)O 282.50 unknown via CMAUP database
Gondoic Acid 5282768 Click to see CCCCCCCCC=CCCCCCCCCCC(=O)O 310.50 unknown https://doi.org/10.1021/JF401710H
Heneicosanoic acid 16898 Click to see CCCCCCCCCCCCCCCCCCCCC(=O)O 326.60 unknown via CMAUP database
Myristic Acid 11005 Click to see CCCCCCCCCCCCCC(=O)O 228.37 unknown via CMAUP database
Oleic Acid 445639 Click to see CCCCCCCCC=CCCCCCCCC(=O)O 282.50 unknown via CMAUP database
Palmitic Acid 985 Click to see CCCCCCCCCCCCCCCC(=O)O 256.42 unknown https://doi.org/10.1021/NP50045A036
Stearic Acid 5281 Click to see CCCCCCCCCCCCCCCCCC(=O)O 284.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids
Nonanoic acid 8158 Click to see CCCCCCCCC(=O)O 158.24 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Straight chain fatty acids
Butyric Acid 264 Click to see CCCC(=O)O 88.11 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Very long-chain fatty acids
(113C)Tetracosanoic acid 16213616 Click to see CCCCCCCCCCCCCCCCCCCCCCCC(=O)O 369.60 unknown via CMAUP database
Behenic Acid 8215 Click to see CCCCCCCCCCCCCCCCCCCCCC(=O)O 340.60 unknown via CMAUP database
Tetracosanoate 5461021 Click to see CCCCCCCCCCCCCCCCCCCCCCCC(=O)[O-] 367.60 unknown via CMAUP database
Tetracosanoic acid 11197 Click to see CCCCCCCCCCCCCCCCCCCCCCCC(=O)O 368.60 unknown via CMAUP database
Tricosanoic acid 17085 Click to see CCCCCCCCCCCCCCCCCCCCCCC(=O)O 354.60 unknown https://doi.org/10.1021/JF401710H
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters
Decyl propionate 229385 Click to see CCCCCCCCCCOC(=O)CC 214.34 unknown via CMAUP database
Oxalic acid, 2-ethylhexyl octadecyl ester 6420794 Click to see CCCCCCCCCCCCCCCCCCOC(=O)C(=O)OCC(CC)CCCC 454.70 unknown via CMAUP database
Pentadecyl acrylate 543579 Click to see CCCCCCCCCCCCCCCOC(=O)C=C 282.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
1-Dodecanol 8193 Click to see CCCCCCCCCCCCO 186.33 unknown via CMAUP database
1-Undecanol 8184 Click to see CCCCCCCCCCCO 172.31 unknown via CMAUP database
2-Butyl-1-octanol 19800 Click to see CCCCCCC(CCCC)CO 186.33 unknown via CMAUP database
2-Hexyl-1-decanol 95337 Click to see CCCCCCCCC(CCCCCC)CO 242.44 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Annonaceous acetogenins
(2S)-4-[(2R,13R)-2,13-dihydroxy-13-[(5S)-5-[(2S)-5-[(1S)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one 5352043 Click to see CCCCCCCCCCC(C1CCC(O1)C2CCC(O2)C(CCCCCCCCCCC(CC3=CC(OC3=O)C)O)O)O 622.90 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Long-chain fatty alcohols
(R)-nonacosan-10-ol 342803 Click to see CCCCCCCCCCCCCCCCCCCC(CCCCCCCCC)O 424.80 unknown via CMAUP database
1-Eicosanol 12404 Click to see CCCCCCCCCCCCCCCCCCCCO 298.50 unknown via CMAUP database
1-Tridecanol 8207 Click to see CCCCCCCCCCCCCO 200.36 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty aldehydes
(Z)-7-Hexadecenal 5364438 Click to see CCCCCCCCC=CCCCCCC=O 238.41 unknown via CMAUP database
7-Hexadecenal 5283374 Click to see CCCCCCCCC=CCCCCCC=O 238.41 unknown via CMAUP database
Hexadecanal 984 Click to see CCCCCCCCCCCCCCCC=O 240.42 unknown via CMAUP database
Pentadecanal 17697 Click to see CCCCCCCCCCCCCCC=O 226.40 unknown via CMAUP database
Tetradecanal 31291 Click to see CCCCCCCCCCCCCC=O 212.37 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
1-Monolinolein 117319 Click to see CCCCCC=CCC=CCCCCCCCC(=O)OCC(CO)O 354.50 unknown via CMAUP database
3-Linoleoyl-sn-glycerol 40489139 Click to see CCCCCC=CCC=CCCCCCCCC(=O)OCC(CO)O 354.50 unknown via CMAUP database
alpha-Glyceryl linoleate 6436630 Click to see CCCCCC=CCC=CCCCCCCCC(=O)OCC(CO)O 354.50 unknown via CMAUP database
Glyceryl monolinoleate 5283469 Click to see CCCCCC=CCC=CCCCCCCCC(=O)OCC(CO)O 354.50 unknown https://doi.org/10.1021/JF401710H
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
> Lipids and lipid-like molecules / Glycerolipids / Diradylglycerols / Diacylglycerols / 1,3-diacylglycerols
Glyceryl 1,3-dipalmitate 68149 Click to see CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)O 568.90 unknown via CMAUP database
> Lipids and lipid-like molecules / Glycerolipids / Monoradylglycerols / Monoacylglycerols / 1-monoacylglycerols
(2s)-2,3-Dihydroxypropyl (9z)-Octadec-9-Enoate 12178130 Click to see CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)O 356.50 unknown via CMAUP database
1-Hexadecanoyl-sn-glycerol 3084463 Click to see CCCCCCCCCCCCCCCC(=O)OCC(CO)O 330.50 unknown via CMAUP database
2,3-Dihydroxypropyl hexadecanoate 14900 Click to see CCCCCCCCCCCCCCCC(=O)OCC(CO)O 330.50 unknown https://doi.org/10.1021/JF401710H
Glyceryl monooleate 5283468 Click to see CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)O 356.50 unknown https://doi.org/10.1021/JF401710H
> Lipids and lipid-like molecules / Glycerolipids / Monoradylglycerols / Monoacylglycerols / 2-monoacylglycerols
1,3-Dihydroxypropan-2-yl docosanoate 121658 Click to see CCCCCCCCCCCCCCCCCCCCCC(=O)OC(CO)CO 414.70 unknown via CMAUP database
2-Palmitoylglycerol 123409 Click to see CCCCCCCCCCCCCCCC(=O)OC(CO)CO 330.50 unknown https://doi.org/10.1021/JF401710H
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Aconitane-type diterpenoid alkaloids
[(1S,4S,5R,6S,8R,9R,13S,16S,18S)-4-acetyloxy-11-ethyl-8,9-dihydroxy-6,16,18-trimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl]methyl 2-[(3S)-3-methyl-2,5-dioxopyrrolidin-1-yl]benzoate 44363340 Click to see CCN1CC2(CCC(C34C2C(C(C31)(C5(CC(C6CC4C5C6OC(=O)C)OC)O)O)OC)OC)COC(=O)C7=CC=CC=C7N8C(=O)CC(C8=O)C 710.80 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids
(5Z,9Z)-6,10,14-trimethylpentadeca-5,9,13-trien-2-one 1711942 Click to see CC(=CCCC(=CCCC(=CCCC(=O)C)C)C)C 262.40 unknown via CMAUP database
3,7,11,15-Tetramethyl-2-hexadecen-1-OL 5366244 Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C 296.50 unknown https://doi.org/10.5650/JOS1956.32.48
3,7,11,15-Tetramethylhexadecyl acetate 545558 Click to see CC(C)CCCC(C)CCCC(C)CCCC(C)CCOC(=O)C 340.60 unknown via CMAUP database
6,10,14-Trimethylpentadeca-5,9,13-trien-2-one 61206 Click to see CC(=CCCC(=CCCC(=CCCC(=O)C)C)C)C 262.40 unknown via CMAUP database
Farnesylacetone 1711945 Click to see CC(=CCCC(=CCCC(=CCCC(=O)C)C)C)C 262.40 unknown via CMAUP database
Isophytol 10453 Click to see CC(C)CCCC(C)CCCC(C)CCCC(C)(C=C)O 296.50 unknown via CMAUP database
Phytane 12523 Click to see CCC(C)CCCC(C)CCCC(C)CCCC(C)C 282.50 unknown via CMAUP database
Phytol 5280435 Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C 296.50 unknown https://doi.org/10.5650/JOS1956.32.48
Pristane 15979 Click to see CC(C)CCCC(C)CCCC(C)CCCC(C)C 268.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
Geraniol 637566 Click to see CC(=CCCC(=CCO)C)C 154.25 unknown via CMAUP database
Geranylacetone 1549778 Click to see CC(=CCCC(=CCCC(=O)C)C)C 194.31 unknown via CMAUP database
Linalool, (+/-)- 6549 Click to see CC(=CCCC(C)(C=C)O)C 154.25 unknown https://doi.org/10.5650/JOS1956.32.48
https://doi.org/10.1080/10412905.1991.9697932
Nerol 643820 Click to see CC(=CCCC(=CCO)C)C 154.25 unknown via CMAUP database
Pseudoionone 1757003 Click to see CC(=CCCC(=CC=CC(=O)C)C)C 192.30 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
(+)-Bornyl acetate 6950274 Click to see CC(=O)OC1CC2CCC1(C2(C)C)C 196.29 unknown via CMAUP database
(1R,2S,4R)-(+)-Bornyl acetate 443131 Click to see CC(=O)OC1CC2CCC1(C2(C)C)C 196.29 unknown via CMAUP database
(1S,2R,4S)-(-)-Bornyl acetate 442460 Click to see CC(=O)OC1CC2CCC1(C2(C)C)C 196.29 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
L-Born-2-yl acetate 44630108 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
(-)-Dihydrocarveol 443163 Click to see CC1CCC(CC1O)C(=C)C 154.25 unknown via CMAUP database
(+)-Dihydrocarveol 89755 Click to see CC1CCC(CC1O)C(=C)C 154.25 unknown via CMAUP database
3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, 1-acetate, (1R)- 11469649 Click to see CC1=CCC(CC1)C(C)(C)OC(=O)C 196.29 unknown via CMAUP database
4-Terpineol, (+/-)- 11230 Click to see CC1=CCC(CC1)(C(C)C)O 154.25 unknown https://doi.org/10.1080/10412905.1991.9697932
alpha-Terpinene 7462 Click to see CC1=CC=C(CC1)C(C)C 136.23 unknown https://doi.org/10.1080/10412905.1991.9697932
Alpha-Terpineol 17100 Click to see CC1=CCC(CC1)C(C)(C)O 154.25 unknown https://doi.org/10.1080/10412905.1991.9697932
alpha-Terpinyl acetate 111037 Click to see CC1=CCC(CC1)C(C)(C)OC(=O)C 196.29 unknown via CMAUP database
Dihydrocarveol 12072 Click to see CC1CCC(CC1O)C(=C)C 154.25 unknown via CMAUP database
Terpinolene 11463 Click to see CC1=CCC(=C(C)C)CC1 136.23 unknown https://doi.org/10.1080/10412905.1991.9697932
> Lipids and lipid-like molecules / Prenol lipids / Retinoids
Retinyl acetate 638034 Click to see CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CCOC(=O)C)C)C 328.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
(+)-Boscialin 10846879 Click to see CC1CC(CC(C1(C=CC(=O)C)O)(C)C)O 226.31 unknown https://doi.org/10.1016/J.BMCL.2013.04.013
(E,Z)-farnesol 1549109 Click to see CC(=CCCC(=CCCC(=CCO)C)C)C 222.37 unknown via CMAUP database
(E)-3-Hydroxy-5,6-dihydro-beta-ionone 21630918 Click to see CC1CC(CC(C1C=CC(=O)C)(C)C)O 210.31 unknown via CMAUP database
2-Pentanone, 4-(2,6,6-trimethyl-2-cyclohexenyl) 579168 Click to see CC1=CCCC(C1C(C)CC(=O)C)(C)C 208.34 unknown via CMAUP database
3,7,11-Trimethyl-1-dodecanol 138824 Click to see CC(C)CCCC(C)CCCC(C)CCO 228.41 unknown via CMAUP database
4-[(S)-3-Hydroxybutylidene]-3,5,5-trimethyl-2-cyclohexen-1-one 73354989 Click to see CC1=CC(=O)CC(C1=CCC(C)O)(C)C 208.30 unknown via CMAUP database
6,10,14-Trimethylpentadecan-2-one 10408 Click to see CC(C)CCCC(C)CCCC(C)CCCC(=O)C 268.50 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
Caryophyllene 5281515 Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C 204.35 unknown https://doi.org/10.1080/10412905.1991.9697932
Caryophyllene,alpha + beta mixt. 5354499 Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C 204.35 unknown https://doi.org/10.1080/10412905.1991.9697932
cis,cis-Farnesol 1549107 Click to see CC(=CCCC(=CCCC(=CCO)C)C)C 222.37 unknown via CMAUP database
Dehydrovomifoliol 688492 Click to see CC1=CC(=O)CC(C1(C=CC(=O)C)O)(C)C 222.28 unknown https://doi.org/10.1016/J.BMCL.2013.04.013
Farnesol 3327 Click to see CC(=CCCC(=CCCC(=CCO)C)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 via CMAUP database
Vomifoliol 5280462 Click to see CC1=CC(=O)CC(C1(C=CC(C)O)O)(C)C 224.30 unknown https://doi.org/10.1016/J.BMCL.2013.04.013
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Cedrane and isocedrane sesquiterpenoids
Cedrol 65575 Click to see CC1CCC2C13CCC(C(C3)C2(C)C)(C)O 222.37 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids
alpha-Elemol 6429032 Click to see CC(=C)C1CC(CCC1(C)C=C)C(C)(C)O 222.37 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
beta-EUDESMOL 91457 Click to see CC12CCCC(=C)C1CC(CC2)C(C)(C)O 222.37 unknown via CMAUP database
gamma-EUDESMOL 6432005 Click to see CC1=C2CC(CCC2(CCC1)C)C(C)(C)O 222.37 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides
(Z)-4-[(1S,4R,6S)-2,2,6-trimethyl-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl]but-3-en-2-one 71654867 Click to see CC1CC(CC(C1C=CC(=O)C)(C)C)OC2C(C(C(C(O2)CO)O)O)O 372.50 unknown via CMAUP database
Byzantionoside A 73345910 Click to see CC1=CC(CC(C1C=CC(=O)C)(C)C)OC2C(C(C(C(O2)CO)O)O)O 370.40 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(24R)-3alpha,24,25-Trihydroxytirucalla-8-ene-21-oic acid 102253059 Click to see CC1(C2CCC3=C(C2(CCC1O)C)CCC4(C3(CCC4C(CCC(C(C)(C)O)O)C(=O)O)C)C)C 490.70 unknown via CMAUP database
(24S)-3alpha,24,25-Trihydroxytirucalla-8-ene-21-oic acid 102253057 Click to see CC1(C2CCC3=C(C2(CCC1O)C)CCC4(C3(CCC4C(CCC(C(C)(C)O)O)C(=O)O)C)C)C 490.70 unknown via CMAUP database
3alpha,25-Dihydroxytirucalla-8-ene-21-oic acid 102253060 Click to see CC1(C2CCC3=C(C2(CCC1O)C)CCC4(C3(CCC4C(CCCC(C)(C)O)C(=O)O)C)C)C 474.70 unknown via CMAUP database
3alpha,25-Dihydroxytirucalla-8-ene-21-oic acid methyl ester 102253058 Click to see CC1(C2CCC3=C(C2(CCC1O)C)CCC4(C3(CCC4C(CCCC(C)(C)O)C(=O)OC)C)C)C 488.70 unknown via CMAUP database
9-Hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid 2371 Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O 456.70 unknown https://doi.org/10.1055/S-2006-957705
alpha-Elemolic acid methyl ester 102253061 Click to see CC(=CCCC(C1CCC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)O)C)C)C)C(=O)OC)C 470.70 unknown via CMAUP database
Betulinic Acid 64971 Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C(=O)O 456.70 unknown https://doi.org/10.1055/S-2006-957705
Lanosterol 246983 Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)O)C)C)C 426.70 unknown via CMAUP database
Olean-12-en-3beta-ol 225689 Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C)C 426.70 unknown via CMAUP database
Urs-12-en-3beta-ol 225688 Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C 426.70 unknown via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cycloartanols and derivatives
(1S,3R,6S,15R,16R)-15-(7-hydroxy-6-methyl-5-methylideneheptan-2-yl)-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol 5319721 Click to see CC(CCC(=C)C(C)CO)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C 456.70 unknown via CMAUP database
9,19-Cyclo-9beta-lanost-24-en-3beta-ol 500213 Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C 426.70 unknown https://doi.org/10.1248/BPB.33.267
Cycloartenol 92110 Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C 426.70 unknown https://doi.org/10.1248/BPB.33.267
> 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 / Steroid lactones / Bufanolides and derivatives
Gamabufotalin 259803 Click to see CC12CCC(CC1CCC3C2C(CC4(C3(CCC4C5=COC(=O)C=C5)O)C)O)O 402.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
(-)-beta-Sitosterol 6432744 Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C 414.70 unknown via CMAUP database
17-(5-Ethyl-6-methylhept-3-en-2-yl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 255607 Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(C)C 410.70 unknown https://doi.org/10.1007/S10600-011-9919-Z
17-(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 86821 Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C 414.70 unknown https://doi.org/10.1021/NP50045A036
Beta-Sitosterol 222284 Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C 414.70 unknown via CMAUP database
beta-Sitosterol 3-O-beta-D-galactopyranoside 296119 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 https://doi.org/10.1007/BF02976956
Fucosterol 5281326 Click to see CC=C(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C 412.70 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 https://doi.org/10.1021/NP50045A036
https://doi.org/10.1007/BF02976956
Sitostenone 579897 Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(C)C 412.70 unknown https://doi.org/10.1007/S10600-011-9919-Z
Stigmast-4-en-3-one 5484202 Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(C)C 412.70 unknown https://doi.org/10.1007/S10600-011-9919-Z
Stigmasta-4,22-dien-3-one 6442194 Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(C)C 410.70 unknown https://doi.org/10.1007/S10600-011-9919-Z
Stigmasterol 5280794 Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C 412.70 unknown via CMAUP database
> Nucleosides, nucleotides, and analogues / Purine nucleosides
5'-O-methyladenosine 6480505 Click to see COCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O 281.27 unknown https://doi.org/10.1248/BPB.33.267
> Organic 1,3-dipolar compounds / Allyl-type 1,3-dipolar organic compounds / Azoxy compounds
Methylazoxymethanol 6433205 Click to see C[N+](=NCO)[O-] 90.08 unknown via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives
Acetic acid, (Z)- 9904352 Click to see CCN1C(=CC(=O)OCC)SC(C1=O)N2CCCCC2 298.40 unknown via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids
2-Ammonio-4-sulfanylbutanoate 49791978 Click to see C(CS)C(C(=O)[O-])[NH3+] 135.19 unknown via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Carbamic acids and derivatives / Carbamic acids
N-Methylcarbamate 21584661 Click to see CNC(=O)[O-] 74.06 unknown via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters
Lauryl 3-mercaptopropionate 80796 Click to see CCCCCCCCCCCCOC(=O)CCS 274.50 unknown via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acids
Hydron;acetate 21980959 Click to see [H+].CC(=O)[O-] 60.05 unknown via CMAUP database
Propionic Acid 1032 Click to see CCC(=O)O 74.08 unknown via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Peroxycarboxylic acids and derivatives / Peroxycarboxylic acids
Peracetic Acid 6585 Click to see CC(=O)OO 76.05 unknown via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives
[2-(4-hexadecanoyloxy-3-hydroxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] hexadecanoate 54686917 Click to see CCCCCCCCCCCCCCCC(=O)OCC(C1C(=C(C(=O)O1)OC(=O)CCCCCCCCCCCCCCC)O)O 652.90 unknown via CMAUP database
> Organic acids and derivatives / Keto acids and derivatives / Beta-keto acids and derivatives
3(10)-Caren-4-ol, acetoacetic acid ester 538448 Click to see CC(=O)CC(=O)OC1CC2C(C2(C)C)CC1=C 236.31 unknown via CMAUP database
> Organic acids and derivatives / Organic carbonic acids and derivatives
Methylcarbamic acid 30536 Click to see CNC(=O)O 75.07 unknown via CMAUP database
> Organic nitrogen compounds / Organonitrogen compounds / Amines / Alkanolamines / 1,2-aminoalcohols
d-Alaninol 80308 Click to see CC(CO)N 75.11 unknown via CMAUP database
DL-Alaninol 5126 Click to see CC(CO)N 75.11 unknown via CMAUP database
L-Alaninol 80307 Click to see CC(CO)N 75.11 unknown via CMAUP database
> Organic oxygen compounds / Organic oxides
beta-Cyclocitral 9895 Click to see CC1=C(C(CCC1)(C)C)C=O 152.23 unknown via CMAUP database
Safranal 61041 Click to see CC1=C(C(CC=C1)(C)C)C=O 150.22 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
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
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
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Primary alcohols
(S)-3-Ethyl-4-methylpentanol 59911029 Click to see CCC(CCO)C(C)C 130.23 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols / Cyclohexanols
Inositol 892 Click to see C1(C(C(C(C(C1O)O)O)O)O)O 180.16 unknown https://doi.org/10.1002/PTR.1847
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols
Epoxy-linalooloxide 537453 Click to see CC1(C(O1)CCC(C)(C2CO2)O)C 186.25 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2,6,6-trimethylcyclohexen-1-yl)methoxy]oxan-2-yl]methoxy]oxane-3,4,5-triol 102169927 Click to see CC1=C(C(CCC1)(C)C)COC2C(C(C(C(O2)COC3C(C(C(C(O3)CO)O)O)O)O)O)O 478.50 unknown https://doi.org/10.1248/BPB.33.267
2-(Hydroxymethyl)-6-[[3,4,5-trihydroxy-6-[(2,6,6-trimethylcyclohexen-1-yl)methoxy]oxan-2-yl]methoxy]oxane-3,4,5-triol 162992062 Click to see CC1=C(C(CCC1)(C)C)COC2C(C(C(C(O2)COC3C(C(C(C(O3)CO)O)O)O)O)O)O 478.50 unknown https://doi.org/10.1248/BPB.33.267
Icariside B2 10385469 Click to see CC(=O)C=CC12C(CC(CC1(O2)C)OC3C(C(C(C(O3)CO)O)O)O)(C)C 386.40 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
2-(Hydroxymethyl)-6-(4-hydroxyphenoxy)oxane-3,4,5-triol 346 Click to see C1=CC(=CC=C1O)OC2C(C(C(C(O2)CO)O)O)O 272.25 unknown https://doi.org/10.1002/PTR.1847
2-(Hydroxymethyl)-6-[4-(hydroxymethyl)-2-methoxyphenoxy]oxane-3,4,5-triol 69086659 Click to see COC1=C(C=CC(=C1)CO)OC2C(C(C(C(O2)CO)O)O)O 316.30 unknown https://doi.org/10.1248/BPB.33.267
Arbutin 440936 Click to see C1=CC(=CC=C1O)OC2C(C(C(C(O2)CO)O)O)O 272.25 unknown via CMAUP database
Vanilloloside 44577222 Click to see COC1=C(C=CC(=C1)CO)OC2C(C(C(C(O2)CO)O)O)O 316.30 unknown https://doi.org/10.1248/BPB.33.267
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes
2-Hexenal 5281168 Click to see CCCC=CC=O 98.14 unknown via CMAUP database
Dodecanal 8194 Click to see CCCCCCCCCCCC=O 184.32 unknown via CMAUP database
Nonanal 31289 Click to see CCCCCCCCC=O 142.24 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Enones
3-Decen-5-one 5367760 Click to see CCCCCC(=O)C=CCC 154.25 unknown via CMAUP database
4-(2,4,4-Trimethyl-cyclohexa-1,5-dienyl)-but-3-en-2-one 5363898 Click to see CC1=C(C=CC(C1)(C)C)C=CC(=O)C 190.28 unknown via CMAUP database
6,10-Dimethylundecadien-2-one 14619638 Click to see CC(C)CCCC(=CC=CC(=O)C)C 194.31 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones
Cyclohexanone 7967 Click to see C1CCC(=O)CC1 98.14 unknown via CMAUP database
Cyclopentanone, 2-(5-oxohexyl)- 558468 Click to see CC(=O)CCCCC1CCCC1=O 182.26 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones
Megastigmatrienone A 6437599 Click to see CC=CC=C1C(=CC(=O)CC1(C)C)C 190.28 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
(6R)-6,10-dimethylundecan-2-one 1715160 Click to see CC(C)CCCC(C)CCCC(=O)C 198.34 unknown via CMAUP database
6-Methyl-5-hepten-2-one 9862 Click to see CC(=CCCC(=O)C)C 126.20 unknown via CMAUP database
6,10-Dimethylundecan-2-one 95495 Click to see CC(C)CCCC(C)CCCC(=O)C 198.34 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones / Alpha-diketones
2,3-Octanedione 11449 Click to see CCCCCC(=O)C(=O)C 142.20 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones / Beta-hydroxy ketones
Diacetone Alcohol 31256 Click to see CC(=O)CC(C)(C)O 116.16 unknown via CMAUP database
> Organohalogen compounds / Organochlorides
1-Chlorooctadecane 18815 Click to see CCCCCCCCCCCCCCCCCCCl 288.90 unknown via CMAUP database
Oleyl chloride 5367784 Click to see CCCCCCCCC=CCCCCCCCCCl 286.90 unknown via CMAUP database
> Organohalogen compounds / Sulfonyl halides / Sulfonyl chlorides
1-Hexadecanesulfonyl chloride 96923 Click to see CCCCCCCCCCCCCCCCS(=O)(=O)Cl 325.00 unknown via CMAUP database
> Organoheterocyclic compounds / Benzofurans
(+)-Epiloliolide 44511808 Click to see CC1(CC(CC2(C1=CC(=O)O2)C)O)C 196.24 unknown https://doi.org/10.1016/J.BMCL.2013.04.013
> Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / Xanthones
Norathyriol 5281656 Click to see C1=C(C=C2C(=C1O)C(=O)C3=CC(=C(C=C3O2)O)O)O 260.20 unknown via CMAUP database
> Organoheterocyclic compounds / Diazines / Pyrazines
2-(Bromomethyl)pyrazine 12752238 Click to see C1=CN=C(C=N1)CBr 173.01 unknown via CMAUP database
Pyrazine 9261 Click to see C1=CN=CC=N1 80.09 unknown via CMAUP database
> Organoheterocyclic compounds / Dihydrofurans / Furanones / Butenolides
2(3H)-Furanone 140765 Click to see C1C=COC1=O 84.07 unknown via CMAUP database
> Organoheterocyclic compounds / Dihydroisoquinolines
Pycnarrhine 20056242 Click to see C[N+]1=CC2=CC(=C(C=C2CC1)OC)O 192.23 unknown via CMAUP database
> Organoheterocyclic compounds / Heteroaromatic compounds
2-Pentylfuran 19602 Click to see CCCCCC1=CC=CO1 138.21 unknown via CMAUP database
> Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives / 6-aminopurines
Adenine 190 Click to see C1=NC2=NC=NC(=C2N1)N 135.13 unknown via CMAUP database
> Organoheterocyclic compounds / Indoles and derivatives / Indoles
2-Methylindole-3-carboxaldehyde 73166 Click to see CC1=C(C2=CC=CC=C2N1)C=O 159.18 unknown via CMAUP database
> Organoheterocyclic compounds / Indoles and derivatives / Indolyl carboxylic acids and derivatives
(2S)-2-azaniumyl-3-(1H-indol-3-yl)propanoate 6923516 Click to see C1=CC=C2C(=C1)C(=CN2)CC(C(=O)[O-])[NH3+] 204.22 unknown via CMAUP database
D-Tryptophan 9060 Click to see C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)N 204.22 unknown via CMAUP database
> Organoheterocyclic compounds / Isoquinolines and derivatives / Benzylisoquinolines
(-)-Armepavine 442169 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)OC)OC 313.40 unknown https://doi.org/10.1021/NP50052A044
https://doi.org/10.1248/YAKUSHI1947.82.10_1458
https://doi.org/10.1248/YAKUSHI1947.90.9_1165
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3843740/
(-)-Neferine 134693217 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC 624.80 unknown https://doi.org/10.1016/J.PHYMED.2008.09.005
https://doi.org/10.1021/NP50045A036
(+)-Armepavine 680292 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)OC)OC 313.40 unknown https://doi.org/10.1016/J.EJPHAR.2005.11.062
(+)-Higenamine 440988 Click to see C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=C(C=C3)O 271.31 unknown via CMAUP database
(+)-Isoliensinine 71210437 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)O)O)OC 610.70 unknown via CMAUP database
(+)-N-Methylisococlaurine 21817819 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)OC)O 299.40 unknown via CMAUP database
(7-Hydroxy-6-methoxy-3,4-dihydroisoquinolin-1-yl)-(4-methoxyphenyl)methanone 183656 Click to see COC1=CC=C(C=C1)C(=O)C2=NCCC3=CC(=C(C=C32)O)OC 311.30 unknown via CMAUP database
(R)-Coclaurine 440989 Click to see COC1=C(C=C2C(NCCC2=C1)CC3=CC=C(C=C3)O)O 285.34 unknown https://doi.org/10.1016/J.BMC.2004.10.020
(R)-N-Methylcoclaurine 440595 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)O)OC 299.40 unknown https://doi.org/10.1016/J.BMC.2004.10.020
(R)-N-methylcoclaurinium 6971067 Click to see C[NH+]1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)O)OC 300.40 unknown via CMAUP database
(S)-N-Methylcoclaurine 440584 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)O)OC 299.40 unknown via CMAUP database
(S)-N-methylcoclaurinium(1+) 6971065 Click to see C[NH+]1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)O)OC 300.40 unknown via CMAUP database
(S)-Norcoclaurine 440927 Click to see C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=C(C=C3)O 271.31 unknown https://doi.org/10.1016/J.BMC.2004.10.020
1-{[4-Hydroxy-3-({6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-yl}oxy)phenyl]methyl}-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol 10100278 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)O)O)OC 610.70 unknown https://doi.org/10.1248/CPB.59.947
1-Benzyl-2-methyl-1,2,3,4-tetrahydroisoquinoline 440630 Click to see CN1CCC2=CC=CC=C2C1CC3=CC=CC=C3 237.34 unknown via CMAUP database
4-[(6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-2-({1-[(4-hydroxyphenyl)methyl]-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-7-yl}oxy)phenol 11621414 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC 610.70 unknown https://doi.org/10.1248/YAKUSHI1947.85.4_353
https://doi.org/10.1248/CPB.59.947
https://doi.org/10.1248/YAKUSHI1947.86.1_75
4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-2-[4-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]phenoxy]phenol 235244 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC)OC 624.80 unknown https://doi.org/10.1021/JF501644T
5-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]-2-[[6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol 163045620 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC)OC4=C(C=C(C=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC 624.80 unknown https://doi.org/10.1248/YAKUSHI1947.85.4_335
5-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-[[(1R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenol 163045621 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC)OC4=C(C=C(C=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC 624.80 unknown https://doi.org/10.1248/YAKUSHI1947.85.4_335
6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinoline 5319720 Click to see CN1CCC2=C(C1CC3=CC=C(C=C3)OC)C=CC(=C2)OC 297.40 unknown https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3843740/
Armepavine 98348 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)OC)OC 313.40 unknown https://doi.org/10.1248/YAKUSHI1947.90.9_1165
https://doi.org/10.1016/J.EJPHAR.2005.11.062
https://doi.org/10.1248/YAKUSHI1947.82.10_1458
CID 398793 398793 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC 624.80 unknown https://doi.org/10.1016/J.PHYMED.2008.09.005
https://doi.org/10.1021/JF501644T
https://doi.org/10.1248/CPB.59.947
https://doi.org/10.1021/NP50045A036
Coclaurine 160487 Click to see COC1=C(C=C2C(NCCC2=C1)CC3=CC=C(C=C3)O)O 285.34 unknown via CMAUP database
Dauricine 73400 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC)OC 624.80 unknown via CMAUP database
Higenamine 114840 Click to see C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=C(C=C3)O 271.31 unknown https://doi.org/10.1016/J.BMC.2004.10.020
Isoliensinine 5274591 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)O)O)OC 610.70 unknown https://doi.org/10.1016/J.PHYMED.2008.09.005
https://doi.org/10.1021/JF501644T
https://doi.org/10.1248/CPB.59.947
https://doi.org/10.1021/NP50045A036
Liensinine 160644 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC 610.70 unknown https://doi.org/10.1016/J.PHYMED.2008.09.005
https://doi.org/10.1248/YAKUSHI1947.85.4_353
https://doi.org/10.1016/J.JEP.2005.09.025
https://doi.org/10.1248/CPB.59.947
https://doi.org/10.1021/NP50045A036
https://doi.org/10.1248/YAKUSHI1947.86.1_75
Lotusine 5274587 Click to see C[N+]1(CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)OC)O)C 314.40 unknown https://doi.org/10.1016/J.JEP.2005.09.025
https://doi.org/10.1021/NP50045A036
Machiline 281691 Click to see COC1=C(C=C2C(NCCC2=C1)CC3=CC=C(C=C3)O)O 285.34 unknown https://doi.org/10.1016/J.BMC.2004.10.020
N-Methylcoclaurine 2752274 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)O)O)OC 299.40 unknown https://doi.org/10.1016/J.BMC.2004.10.020
Neferine 159654 Click to see CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC)O)OC 624.80 unknown https://doi.org/10.1248/CPB.59.947
Norarmepavine 317405 Click to see COC1=C(C=C2C(NCCC2=C1)CC3=CC=C(C=C3)O)OC 299.40 unknown via CMAUP database
> Organoheterocyclic compounds / Isoquinolines and derivatives / Isoquinolones and derivatives
Thalifoline 89048 Click to see CN1CCC2=CC(=C(C=C2C1=O)O)OC 207.23 unknown https://doi.org/10.1016/J.PHYMED.2008.09.005
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
Andrographolide 5318517 Click to see CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)O 350.40 unknown via CMAUP database
> Organoheterocyclic compounds / Oxepanes
(3S,5R,6S,7E)-5,6-Epoxy-3-hydroxy-7-megastigmen-9-one 14605580 Click to see CC(=O)C=CC12C(CC(CC1(O2)C)O)(C)C 224.30 unknown via CMAUP database
Annuionone D 14605579 Click to see CC(=O)C=CC12C(CC(CC1(O2)C)O)(C)C 224.30 unknown via CMAUP database
beta-Ionone epoxide 5352481 Click to see CC(=O)C=CC12C(CCCC1(O2)C)(C)C 208.30 unknown via CMAUP database
> Organoheterocyclic compounds / Quinolines and derivatives / Benzoquinolines
Benzo[f]quinoline 6796 Click to see C1=CC=C2C(=C1)C=CC3=C2C=CC=N3 179.22 unknown via CMAUP database
> Organoheterocyclic compounds / Tetrahydroisoquinolines
(+)-Oleracein E 54597686 Click to see C1CC(=O)N2C1C3=CC(=C(C=C3CC2)O)O 219.24 unknown via CMAUP database
(1S)-6-methoxy-1,2-dimethyl-3,4-dihydro-1H-isoquinolin-7-ol 2752120 Click to see CC1C2=CC(=C(C=C2CCN1C)OC)O 207.27 unknown via CMAUP database
1,2,3,4-Tetrahydroisoquinoline 7046 Click to see C1CNCC2=CC=CC=C21 133.19 unknown via CMAUP database
2-Methyl-1,2,3,4-tetrahydroisoquinoline 15362 Click to see CN1CCC2=CC=CC=C2C1 147.22 unknown via CMAUP database
6,7-Dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinoline 27694 Click to see CN1CCC2=CC(=C(C=C2C1)OC)OC 207.27 unknown https://doi.org/10.1021/NP50045A036
> Organosulfur compounds / Thiocarbonyl compounds / Thioaldehydes / Thioaldehyde s-oxides
Propanethial S-oxide, (1Z)- 441491 Click to see CCC=S=O 90.15 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
cis-Cinnamic acid 5372954 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
n-cis-Feruloyltyramine 6440659 Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)O 313.30 unknown https://doi.org/10.1016/J.BMCL.2013.04.013
N-feruloyltyramine; Moupinamide 125213 Click to see COC1=C(C=CC(=C1)C=CC(=O)NCCC2=CC=C(C=C2)O)O 313.30 unknown https://doi.org/10.1016/J.BMCL.2013.04.013
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
cis-N-p-coumaroyltyramine 13939145 Click to see C1=CC(=CC=C1CCNC(=O)C=CC2=CC=C(C=C2)O)O 283.32 unknown via CMAUP database
Paprazine 5372945 Click to see C1=CC(=CC=C1CCNC(=O)C=CC2=CC=C(C=C2)O)O 283.32 unknown https://doi.org/10.1016/J.BMCL.2013.04.013
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
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
cis-Sinapic acid 1549091 Click to see COC1=CC(=CC(=C1O)OC)C=CC(=O)O 224.21 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
Sinapinic acid 637775 Click to see COC1=CC(=CC(=C1O)OC)C=CC(=O)O 224.21 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids
(2R,2'R,3R,3'R)-2,2'-Bis(3,4-dihydroxyphenyl)-3,3',4,4'-tetrahydro-2H,2'H-4,8'-bichromene-3,3',5,5',7,7'-hexol 5320711 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown via CMAUP database
(2R,3S)-2-(3,4-dihydroxyphenyl)-8-[(2S,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol 12967793 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown via CMAUP database
Catechin-(4alpha-8)-ent-epicatechin 24823045 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown via CMAUP database
Procyanidin B1 11250133 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown via CMAUP database
Procyanidin B2, (+)- 122738 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown via CMAUP database
Procyanidin B3 146798 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown via CMAUP database
Procyanidin B4 147299 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown via CMAUP database
Procyanidin B6 474540 Click to see C1C(C(OC2=C1C(=C(C(=C2)O)C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown https://doi.org/10.1021/JF040325P
Procyanidin B7 13990893 Click to see C1C(C(OC2=C1C(=C(C(=C2)O)C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown via CMAUP database
Procyanidin B8 474541 Click to see C1C(C(OC2=C1C(=C(C(=C2)O)C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown https://doi.org/10.1021/JF040325P
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
(-)-Catechin 73160 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O 290.27 unknown https://doi.org/10.1016/J.BMCL.2013.04.013
(+)-Epicatechin 182232 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O 290.27 unknown via CMAUP database
(2R)-2alpha-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3alpha,4alpha,5,7-tetrol 11208959 Click to see C1=CC(=C(C=C1C2C(C(C3=C(C=C(C=C3O2)O)O)O)O)O)O 306.27 unknown via CMAUP database
2-(3,4-Dihydroxyphenyl)chroman-3,5,7-triol 1203 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O 290.27 unknown https://doi.org/10.1021/JF900950Z
https://doi.org/10.1055/S-2007-990223
Cianidanol 9064 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O 290.27 unknown https://doi.org/10.1055/S-2007-990223
https://doi.org/10.1021/JF900950Z
Elephantorrhizol 11988716 Click to see C1C(C(OC2=C(C(=C(C(=C21)O)O)O)O)C3=CC(=C(C=C3)O)O)O 322.27 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins / Catechin gallates
(-)-Epicatechin gallate 107905 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O 442.40 unknown via CMAUP database
(-)-Epicatechingallate 367141 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O 442.40 unknown via CMAUP database
Epicatechin-3-gallate 65056 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O 442.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins / Epigallocatechins
Leucodelphinidin 44563331 Click to see C1=C(C=C(C(=C1O)O)O)C2C(C(C3=C(C=C(C=C3O2)O)O)O)O 322.27 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones / Flavanonols
(+)-Epitaxifolin 443758 Click to see C1=CC(=C(C=C1C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O 304.25 unknown https://doi.org/10.1016/J.BMCL.2013.04.013
(+/-)-Taxifolin 471 Click to see C1=CC(=C(C=C1C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O 304.25 unknown https://doi.org/10.1016/J.BMCL.2013.04.013
Taxifolin 439533 Click to see C1=CC(=C(C=C1C2C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O 304.25 unknown https://doi.org/10.1016/J.BMCL.2013.04.013
> Phenylpropanoids and polyketides / Flavonoids / Flavones
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(1R,2R,3S,4R,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexoxy]chromen-4-one 15959354 Click to see C1C(C(C(C(C1OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O)CO 462.40 unknown via CMAUP database
2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxychromen-4-one 57339948 Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(OC4O)CO)O)O)O)O 464.40 unknown via CMAUP database
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.BMCL.2013.04.013
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols
Isorhamnetin 5281654 Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O 316.26 unknown via CMAUP database
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 https://doi.org/10.1016/J.BMCL.2013.04.013
https://doi.org/10.1007/BF02976956
Myricetin 5281672 Click to see C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O 318.23 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/10.1055/S-2007-990223
https://doi.org/10.1021/JF900950Z
https://doi.org/10.1016/J.BMCL.2013.04.013
Syringetin 5281953 Click to see COC1=CC(=CC(=C1O)OC)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O 346.30 unknown https://doi.org/10.1016/J.ACA.2012.02.051
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides
Isoorientin 114776 Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(O2)C=C(C(=C3O)C4C(C(C(C(O4)CO)O)O)O)O)O)O 448.40 unknown via CMAUP database
Isovitexin 162350 Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C=C(C(=C3O)C4C(C(C(C(O4)CO)O)O)O)O)O 432.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides / Flavonoid 8-C-glycosides
Isoschaftoside 3084995 Click to see C1C(C(C(C(O1)C2=C(C(=C3C(=C2O)C(=O)C=C(O3)C4=CC=C(C=C4)O)C5C(C(C(C(O5)CO)O)O)O)O)O)O)O 564.50 unknown via CMAUP database
Orientin 5281675 Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O)O 448.40 unknown via CMAUP database
Vitexin 5280441 Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O 432.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-3-O-glucuronides
Kaempferol 3-glucuronide 5318759 Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O 462.40 unknown via CMAUP database
Miquelianin (Quercetin 3-O-glucuronide) 13258914 Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O 478.40 unknown via CMAUP database
Myricetin 3-O-glucuronide 5487413 Click to see C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O 494.40 unknown https://doi.org/10.1016/J.ACA.2012.02.051
Nelumboside 11968794 Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O)O)O 640.50 unknown via CMAUP database
Quercetin 3-glucuronide 12004528 Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O 478.40 unknown https://doi.org/10.1016/J.BMC.2004.10.020
https://doi.org/10.1021/JF900950Z
Querciturone 5274585 Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O 478.40 unknown https://doi.org/10.1016/J.BMC.2004.10.020
https://doi.org/10.1021/JF900950Z
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides
Luteolin 5-glucoside 5317471 Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(O2)C=C(C=C3OC4C(C(C(C(O4)CO)O)O)O)O)O)O 448.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
2-(2,3-Dihydroxyphenyl)-5,7-dihydroxy-3-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one 53399169 Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=C(C(=CC=C5)O)O)O)O)O)O)O)O 610.50 unknown via CMAUP database
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one 5378597 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/10.1021/JF900950Z
https://doi.org/10.1016/J.BMC.2004.10.020
https://doi.org/10.1055/S-2007-990223
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one 44259091 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
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one 11557027 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
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
3-[4,5-Dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one 14825575 Click to see C1C(C(C(C(O1)OC2C(C(C(OC2OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)CO)O)O)O)O)O 596.50 unknown https://doi.org/10.1016/J.BMC.2004.10.020
3-[5-(1,2-Dihydroxyethyl)-3,4-dihydroxyoxolan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one 13179952 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/10.1055/S-2007-990223
4-[5,7-dihydroxy-4-oxo-3-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-yl]-2-hydroxyphenolate 54758589 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-] 463.40 unknown via CMAUP database
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-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 45933931 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)OC)O)O)O)O)O)O 624.50 unknown via CMAUP database
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-chromen-3-yl 6-O-(6-deoxy-alpha-D-mannopyranosyl)-beta-D-glucopyranoside 17751019 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)OC)O)O)O)O)O)O 624.50 unknown via CMAUP database
5,7-Dihydroxy-2-(4-hydroxyphenyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one 5462193 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/10.1021/JF900950Z
https://doi.org/10.1055/S-2007-990223
5,7-dihydroxy-3-{[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one 53809877 Click to see C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O 480.40 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://www.ncbi.nlm.nih.gov/pmc/articles/PMC4184820/
https://doi.org/10.1016/J.BMCL.2013.04.013
https://doi.org/10.1055/S-2007-990223
https://doi.org/10.1016/J.ACA.2012.02.051
https://doi.org/10.1007/BF02976956
https://doi.org/10.1021/JF900950Z
https://doi.org/10.1021/JF501644T
Biorobin 15944778 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
Hyperasid 90657624 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-] 463.40 unknown via CMAUP database
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/10.1021/JF900950Z
https://doi.org/10.1016/J.BMC.2004.10.020
https://doi.org/10.1055/S-2007-990223
https://doi.org/10.1016/J.ACA.2012.02.051
Isolimocitrol 3-beta-D-glucoside 5318586 Click to see COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C(=C(C(=C3O2)OC)O)OC)O)OC4C(C(C(C(O4)CO)O)O)O)O 538.50 unknown via CMAUP database
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 https://doi.org/10.1021/JF900950Z
https://doi.org/10.1016/J.BMC.2004.10.020
https://doi.org/10.1016/J.ACA.2012.02.051
https://doi.org/10.1016/J.BMCL.2013.04.013
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/10.1055/S-2007-990223
isorhamnetin 3-O-glucoside 5318645 Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O 478.40 unknown via CMAUP database
Kaempferol 3-O-D-galactoside 5488283 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 via CMAUP database
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
Myricetin 3-beta-D-glucopyranoside 12311099 Click to see C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O 480.40 unknown https://doi.org/10.1021/JF900950Z
Myricetin 3-galactoside 5491408 Click to see C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O 480.40 unknown via CMAUP database
myricetin 3-O-alpha-D-glucopyranoside 10299455 Click to see C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O 480.40 unknown https://doi.org/10.1021/JF900950Z
Myricetin 3-O-glucoside 22841567 Click to see C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O 480.40 unknown via CMAUP database
Narcissin 5481663 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)OC)O)O)O)O)O)O 624.50 unknown https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3640015/
Quercetin 3-sambubioside 5487635 Click to see C1C(C(C(C(O1)OC2C(C(C(OC2OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)CO)O)O)O)O)O 596.50 unknown https://doi.org/10.1016/J.BMC.2004.10.020
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 https://doi.org/10.1016/J.BMC.2004.10.020
https://doi.org/10.1055/S-2007-990223
Syringetin-3-o-glucoside 5321577 Click to see COC1=CC(=CC(=C1O)OC)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O 508.40 unknown via CMAUP database
Trifolin 5282149 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/10.1007/BF02976956
Vitamin P 5293655 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 https://doi.org/10.1016/J.BMC.2004.10.020
https://doi.org/10.1055/S-2007-990223
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
Isorhamnetin 7-glucoside 6455477 Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O 478.40 unknown via CMAUP database
kaempferol 7-O-glucoside 10095180 Click to see C1=CC(=CC=C1C2=C(C(=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 via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 3-O-methylated flavonoids
5,7-dihydroxy-2-(4-hydroxy-3-methoxy-phenyl)-3-[(1R,2R,3S,4R,5R)-2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexoxy]chromen-4-one 15959353 Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4CC(C(C(C4O)O)O)CO)O 476.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 4-O-methylated flavonoids
Diosmetin 5281612 Click to see COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O 300.26 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 8-O-methylated flavonoids
Isosinensetin 632135 Click to see COC1=C(C=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3OC)OC)OC)OC 372.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Isoflavonoids / Furanoisoflavonoids / Pterocarpans
Hildecarpin 442773 Click to see COC1=C(C=C2C(=C1)C3C(CO2)(C4=CC5=C(C=C4O3)OCO5)O)O 330.29 unknown via CMAUP database
> Phenylpropanoids and polyketides / Linear 1,3-diarylpropanoids / Chalcones and dihydrochalcones / Retro-dihydrochalcones
Loureirin A 5319081 Click to see COC1=CC(=C(C=C1)CCC(=O)C2=CC=C(C=C2)O)OC 286.32 unknown via CMAUP database

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