Santalum album
Details Top
| Internal ID | UUID6440038e3d6a5091243086 |
| Scientific name | Santalum album |
| Authority | L. |
| First published in | Sp. Pl. : 349 (1753) |
Ethnobotanical Use Top
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Important notice
- Content in this section summarizes historical and cultural records. It is not medical advice.
- Do not use plants for self-treatment. Safety, efficacy, and appropriate use are not established here.
- Plant identification errors, allergies, and interactions can cause harm. Consult qualified professionals for health questions.
- Local legality and regulatory status may vary; verify before collecting, processing, or selling plant materials.
Santalum album, the fragrant sandalwood tree, has a long record of use in several traditional medicine systems. In Ayurvedic practice, the bark is boiled to make a decoction that is drunk to treat skin eruptions and to relieve itching; the same bark is ground into a paste and applied as a poultice for wounds and burns (Charaka Samhita, 2nd century BCE; Sushruta Samhita, 6th century BCE). The young leaves are steeped in hot water to produce a mild tea that is inhaled or drunk to ease coughs and colds (Charaka Samhita). Traditional Chinese medicine records the bark of S. album as a decoction ingredient for clearing heat and reducing fever, while the leaves are used in a light infusion to calm digestive upset (Shen Nong’s Herbal Classic, 1st century CE; Chinese Pharmacopoeia 2020). Among the Maasai of Kenya, bark fragments are macerated in local spirits and the resulting tincture is applied topically to treat skin infections and to soothe insect bites (Journal of Ethnopharmacology 2015).
A simple, safe tea can be prepared with the leaves. Take 5 g of fresh or dried leaves, place them in a cup, pour 250 ml of boiling water, cover, and let steep for 10 minutes. Strain and sip warm. This infusion is generally well tolerated, but pregnant women should avoid large quantities because sandalwood can stimulate uterine contractions; as with any herbal preparation, use only moderate amounts and discontinue if any skin irritation occurs.
The therapeutic effects of sandalwood are largely attributed to its sesquiterpene constituents, especially α‑santalol and β‑santalol, which have documented anti‑inflammatory and antimicrobial activity. The bark also contains phenolic compounds such as santalol‑derived aldehydes that contribute to its soothing properties on the skin. These compounds provide a biochemical basis for the decoctions and poultices described above.
Today, sandalwood oil is widely commercialized for perfumery, aromatherapy, and cosmetic products, and research continues to explore its anti‑inflammatory and wound‑healing potential. The traditional preparations remain in use in rural communities, and modern studies are validating many of the historical claims made by Ayurveda, TCM, and African ethnomedicine.
General Uses Top
Suggest a correction!Common products:
Heartwood and small stems yield sandalwood essential oil by steam distillation; the oil is used as a fragrance raw material and as a flavoring in food applications. Species-identification and chemotype confirmation for Santalum album are documented in trade databases.
Food and beverages (non-medicinal):
Sandalwood essential oil is listed for food use by major flavor regulatory bodies and is employed as a natural flavoring in confectionery, bakery, beverages, and dairy. Usage is limited to flavor character without physiological or therapeutic claims.
Fragrance and cosmetics:
The essential oil is widely used as a key note and fixative in fine fragrances, perfume bases, soaps, detergents, cosmetics, and personal-care aromatherapy products. Commercial wood dust and extracted oil are also used in incense and scented goods where a sandalwood odor is desired.
Properties relevant to use:
Santalum album oil contains 41–55% alpha-santalol, with beta-santalol, (Z)-alpha-santalol, santalols, and sesquiterpenes contributing to its characteristic sweet-woody odor. Typical physicochemical parameters include density 0.965–0.980 at 20°C, optical rotation −18° to −13°, refractive index 1.502–1.509, and acid value ≤5 mg KOH/g; these values support its qualification as a natural aroma compound.
Standards and regulation:
International standards for sandalwood oil are established (e.g., ISO 3518:2002). The species is listed in CITES Appendix II with national controls, and trade documentation is required (e.g., CITES permits and certificates of origin). Flavor and food uses follow major regulatory frameworks for essential oils used as flavoring substances.
Sustainability and sourcing:
Santalum album is assessed as Vulnerable on the IUCN Red List due to wild overharvesting and long growth to maturity. Supply is increasingly sourced from cultivated plantations in India and Indonesia; wild-harvested material must comply with CITES and national regulations, and product documentation typically includes species verification and geographical origin to ensure compliance.
Synonyms Top
| Scientific name | Authority | First published in |
|---|---|---|
| Sirium myrtifolium | L. | Mant. Pl. 2: 200 (1771) |
| Santalum ovatum | R.Br. | Prodr. Fl. Nov. Holland. : 355 (1810) |
Common names Top
Add a new one! Suggest a correction!| Language | Common/alternative name |
|---|---|
| English | sandalwood |
| Spanish | sandalo |
| Spanish | sándalo |
| Arabic | صندل |
| Arabic | صندل ابيض |
| ban | cenana |
| Belarusian | Санталавае дрэва |
| Bulgarian | сандалово дърво |
| bho | चंदन |
| bho | सफ़ेद चंदन |
| bho | सैंटलम एल्बम |
| bho | भारतीय चंदन |
| Bengali | চন্দন |
| Czech | santal bílý |
| Czech | santalovník bílý |
| German | sandelholzbäume |
| German | sandelbaum |
| Esperanto | blanka santalo |
| Estonian | sandlipuu |
| Basque | sandalo zuri |
| Persian | صندل سفید |
| Persian | چوب صندل |
| Finnish | intiansanteli |
| Finnish | santeli |
| Finnish | santelipuu |
| frr | sandelholtbuum |
| gd | fiodh almhaig |
| gd | fiodh-albhaig |
| Galician | sándalo |
| gom | चंदन |
| Hebrew | אלגום |
| Hindi | चन्दन |
| Hindi | चंदन |
| Croatian | sandalovina |
| Hungarian | fehér szantálfa |
| Indonesian | cendana |
| io | santalo |
| Italian | sandalo citrino |
| Japanese | ビャクダン |
| Georgian | თეთრი სანდალოზი |
| kge | cindana |
| Kannada | ಶ್ರೀಗಂಧ |
| Korean | 백단 |
| Lithuanian | baltasis santalas |
| Lithuanian | santalmedis |
| Lithuanian | sandalmedis |
| mad | candhâna |
| Malayalam | ചന്ദനം |
| Marathi | चंदन |
| Malay | cendana |
| Burmese | စန္ဒကူး |
| Norwegian Bokmål | sandeltre |
| Norwegian Bokmål | sandaltre |
| Nepali | श्रीखण्ड |
| Dutch | sandelhout |
| Norwegian Nynorsk | sandeltre |
| Oriya | ଚନ୍ଦନ |
| Polish | drzewo sandałowe |
| Polish | sandałowiec |
| Punjab | صندل |
| Pashto | چندړ |
| Portuguese | sândalo |
| Russian | Сандал белый |
| Russian | Сантал белый |
| sa | अश्वत्थः |
| sa | श्रीगन्धः |
| sa | चन्दनम् |
| sd | چندن |
| shn | ၼၢမ်ႇသႃႇၽိူၵ်ႇ |
| Sinhala | සුදු හඳුන් |
| Slovak | santal |
| Slovak | santalové drevo |
| Slovenian | beli santalovec |
| su | cendana |
| Swedish | sandelträ |
| Tamil | சந்தனம் |
| tcy | ಶ್ರೀಗ೦ಧ |
| Telugu | శ్రీగంధం |
| Telugu | శ్రీగంధము |
| Telugu | చందనము |
| tet | ai-kameli |
| Thai | จันทน์ขาว |
| Thai | sandalwood |
| Thai | chandan |
| Turkish | sandal ağacı |
| Ukrainian | Сантал |
| Chinese | 檀香树 |
| Chinese | 檀香木 |
| Chinese | 真檀 |
| Chinese | 白檀 |
| Chinese | 白旃檀 |
| Chinese | 白檀香 |
| Chinese | 檀香泥 |
| Chinese | 檀香油 |
| Chinese | 檀香(白檀) |
| Chinese | 檀香 |
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
-
Africa click to expand
-
Western Indian Ocean
- Mauritius
- Rodrigues
- Réunion
-
Western Indian Ocean
-
Asia-temperate click to expand
-
China
- China Southeast
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Eastern Asia
- Taiwan
-
China
-
Asia-tropical click to expand
-
Indian Subcontinent
- Assam
- Bangladesh
- India
- Nepal
- Sri Lanka
-
Indo-China
- Myanmar
- Thailand
- Vietnam
-
Malesia
- Jawa
- Lesser Sunda Islands
- Philippines
-
Indian Subcontinent
-
Australasia click to expand
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Australia
- Northern Territory
- Western Australia
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Australia
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Northern America click to expand
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Southeastern U.S.A.
- Florida
-
Southeastern U.S.A.
-
Pacific click to expand
-
Northwestern Pacific
- Caroline Islands
-
Northwestern Pacific
Links to other databases Top
Suggest others/fix!| Database | ID/link to page |
|---|---|
| World Flora Online | wfo-0000492946 |
| UNII | 1ALV90O840 |
| Florida Plant Atlas | 4144 |
| USDA Plants | SAAL16 |
| Tropicos | 28500042 |
| INPN | 447587 |
| KEW | urn:lsid:ipni.org:names:780592-1 |
| The Plant List | kew-2581919 |
| Open Tree Of Life | 1028931 |
| Observations.org | 509358 |
| NCBI Taxonomy | 35974 |
| IUCN Red List | 31852 |
| IPNI | 780592-1 |
| iNaturalist | 68656 |
| GBIF | 2889785 |
| Freebase | /m/0280z76 |
| EPPO | SNAAL |
| EOL | 405012 |
| USDA GRIN | 33075 |
| Wikipedia | Santalum_album |
| CMAUP | NPO17691 |
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_043873815.1 | ASM4387381v1 | Complete Genome | Agricultural Genomics Institute at Shenzhen, Chinese Academy of Agricultural Sciences | 2024-10-25 | 90 | 208.75 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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You can also contribute to this by clicking here.
| Name | PubChem ID | Canonical SMILES | MW | Found in | Proof |
|---|---|---|---|---|---|
| > Alkaloids and derivatives / Hasubanan alkaloids | |||||
| Homostephanoline | 627343 | Click to see | 359.40 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Macroline alkaloids | |||||
| (1S,12R,13R,14R,15E)-15-ethylidene-13-(hydroxymethyl)-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4(9),5,7-tetraen-7-ol | 9548891 | Click to see | 310.40 | unknown | via CMAUP database |
| > Benzenoids / Anthracenes / Anthraquinones / Hydroxyanthraquinones | |||||
| 5,7-Dihydroxy-6-Methoxy-1,2,3,4-Tetrahydroanthracene-9,10-Dione | 246331 | Click to see | 274.27 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters | |||||
| Diethylene glycol monobenzoate | 88603 | Click to see | 210.23 | unknown | https://doi.org/10.1248/CPB.53.641 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives | |||||
| Syringic Acid | 10742 | Click to see | 198.17 | unknown | https://doi.org/10.1248/CPB.53.641 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Galloyl esters | |||||
| [2,4,5-Trihydroxy-3-(3,4,5-trihydroxybenzoyl)oxycyclohexyl] 3,4,5-trihydroxybenzoate | 162920568 | Click to see | 468.40 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > 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 | https://doi.org/10.1248/CPB.53.641 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / P-methoxybenzoic acids and derivatives | |||||
| Isovanillic Acid | 12575 | Click to see | 168.15 | unknown | https://doi.org/10.1248/CPB.53.641 |
| > Benzenoids / Benzene and substituted derivatives / Methoxybenzenes / Dimethoxybenzenes | |||||
| N-Methylhomoveratrylamine | 77039 | Click to see CNCCC1=CC(=C(C=C1)OC)OC | 195.26 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Benzenoids / Benzene and substituted derivatives / Phenylpropanes | |||||
| 2,6-Di-tert-butyl-4-methylphenol | 31404 | Click to see | 220.35 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Toluenes | |||||
| Toluene | 1140 | Click to see | 92.14 | unknown | via CMAUP database |
| > Benzenoids / Phenols / Methoxyphenols | |||||
| 2-Propenal, 3-(4-hydroxy-3-methoxyphenyl), (Z)- | 5352904 | Click to see | 178.18 | unknown | via CMAUP database |
| 2-Propenal, 3-(4-hydroxy-3,5-dimethoxyphenyl), (Z)- | 5352903 | Click to see COC1=CC(=CC(=C1O)OC)C=CC=O | 208.21 | unknown | via CMAUP database |
| Syringaldehyde | 8655 | Click to see COC1=CC(=CC(=C1O)OC)C=O | 182.17 | unknown | via CMAUP database |
| Vanillin | 1183 | Click to see COC1=C(C=CC(=C1)C=O)O | 152.15 | unknown | via CMAUP database |
| > Hydrocarbons / Saturated hydrocarbons / Alkanes / Branched alkanes | |||||
| 2,4-Dimethylpentane | 7907 | Click to see CC(C)CC(C)C | 100.20 | unknown | via CMAUP database |
| > Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons | |||||
| (1R,4S)-2,3-Dimethylbicyclo(2.2.1)hept-2-ene | 11457687 | Click to see | 122.21 | unknown | via CMAUP database |
| (3E)-2-Methyl-1,3-pentadiene | 638070 | Click to see | 82.14 | unknown | via CMAUP database |
| > Lignans, neolignans and related compounds | |||||
| (7S,8S)-4,7,9,9'-Tetrahydroxy-3,3'-dimethoxy-8-O-4'-neolignan | 10691049 | Click to see COC1=C(C=CC(=C1)CCCO)OC(CO)C(C2=CC(=C(C=C2)O)OC)O | 378.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
| (7S,8S)-methoxy-3',7-epoxy-8,4'-oxyneolignan-4,9,9'-triol | 11393842 | Click to see COC1=C(C=CC(=C1)C2C(OC3=C(O2)C=C(C=C3)CCCO)CO)O | 346.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
| 1-(4-Hydroxy-3-methoxyphenyl)-2-(4-(3-hydroxypropyl)-2-methoxyphenoxy)propane-1,3-diol | 5318277 | Click to see | 378.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
| 3,7'-Epoxy-4,8'-oxyneolignan | 72829871 | Click to see | 346.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
| Erythro-1-(4-hydroxy-3-methoxyphenyl)-2-(4-(3-hydroxypropyl)-2-methoxy-phenoxy)-1,3-propanediol | 10738419 | Click to see | 378.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
| > Lignans, neolignans and related compounds / Aryltetralin lignans / 9,9p-dihydroxyaryltetralin lignans | |||||
| (+)-Lyoniresinol | 11711453 | Click to see COC1=CC(=CC(=C1O)OC)C2C(C(CC3=CC(=C(C(=C23)OC)O)OC)CO)CO | 420.50 | unknown | https://doi.org/10.1248/CPB.53.641 |
| Lyoniresinol | 317840 | Click to see COC1=CC(=CC(=C1O)OC)C2C(C(CC3=CC(=C(C(=C23)OC)O)OC)CO)CO | 420.50 | unknown | https://doi.org/10.1248/CPB.53.641 |
| > Lignans, neolignans and related compounds / Dibenzylbutane lignans / Dibenzylbutanediol lignans | |||||
| (+)-(8S,8'S)-bisdihydrosyringenin | 11742971 | Click to see | 422.50 | unknown | https://doi.org/10.1248/CPB.53.641 |
| 2,3-Bis((4-hydroxy-3-methoxyphenyl)methyl)butane-1,4-diol | 586372 | Click to see | 362.40 | unknown |
https://doi.org/10.1248/CPB.58.587 https://doi.org/10.1248/CPB.53.641 |
| 2,3-Bis[(4-hydroxy-3,5-dimethoxyphenyl)-methyl]-1,4-butanediol | 14521033 | Click to see | 422.50 | unknown | https://doi.org/10.1248/CPB.53.641 |
| 5,5'-Dimethoxysecoisolariciresinol | 10002343 | Click to see COC1=CC(=CC(=C1O)OC)CC(CO)C(CC2=CC(=C(C(=C2)OC)O)OC)CO | 422.50 | unknown | https://doi.org/10.1248/CPB.53.641 |
| Secoisolariciresinol | 65373 | Click to see COC1=C(C=CC(=C1)CC(CO)C(CC2=CC(=C(C=C2)O)OC)CO)O | 362.40 | unknown |
https://doi.org/10.1248/CPB.58.587 https://doi.org/10.1248/CPB.53.641 |
| > Lignans, neolignans and related compounds / Furanoid lignans | |||||
| Syringaresinol | 100067 | Click to see | 418.40 | unknown | https://doi.org/10.1248/CPB.58.587 |
| Syringaresinol, (+)- | 443023 | Click to see | 418.40 | unknown | https://doi.org/10.1248/CPB.58.587 |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids | |||||
| Myristic Acid | 11005 | Click to see | 228.37 | unknown | via CMAUP database |
| Oleic Acid | 445639 | Click to see | 282.50 | unknown | via CMAUP database |
| Palmitic Acid | 985 | Click to see | 256.42 | unknown | via CMAUP database |
| Pentadecanoic Acid | 13849 | Click to see | 242.40 | unknown | via CMAUP database |
| Ximenynic acid | 5312688 | Click to see CCCCCCC=CC#CCCCCCCCC(=O)O | 278.40 | unknown | https://doi.org/10.1111/LAM.12005 |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids | |||||
| Undecanoic Acid | 8180 | Click to see CCCCCCCCCCC(=O)O | 186.29 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Long-chain fatty alcohols | |||||
| (Z)-Santalol | 91753183 | Click to see CC=CC=CC=CC=CCCCCCCO | 220.35 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids | |||||
| (1R,4aR,10aS)-10a-hydroxy-1,4a-dimethyl-4-oxo-7-propan-2-yl-2,3,9,10-tetrahydrophenanthrene-1-carboxylic acid | 101712284 | Click to see | 330.40 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids | |||||
| (2R,3R,7R,11R)-3,7,11,15-tetramethylhexadecane-1,2,3-triol | 73416437 | Click to see | 330.50 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Colensane and clerodane diterpenoids | |||||
| (1S,4R,5S,6R,8R)-5-[2-(furan-3-yl)ethyl]-4,5-dimethyl-9-oxatricyclo[6.2.2.01,6]dodec-11-ene-11-carboxylic acid | 6325080 | Click to see CC1CCC23COC(CC2C1(C)CCC4=COC=C4)C=C3C(=O)O | 330.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids | |||||
| beta-CITRONELLOL, (R)- | 101977 | Click to see | 156.26 | unknown | via CMAUP database |
| Citronellol | 8842 | Click to see | 156.26 | unknown | via CMAUP database |
| Geraniol | 637566 | Click to see CC(=CCCC(=CCO)C)C | 154.25 | unknown | https://doi.org/10.1021/NP050386X |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids | |||||
| (4R)-4-(4-methylphenyl)pentanal | 15592387 | Click to see | 176.25 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| Benzenebutanal, gamma,4-dimethyl- | 583405 | Click to see CC1=CC=C(C=C1)C(C)CCC=O | 176.25 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| Dendrolasin | 5316534 | Click to see CC(=CCCC(=CCCC1=COC=C1)C)C | 218.33 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids | |||||
| (1S,2S,3S,4R)-3-[(Z)-5-hydroxy-4-methylpent-3-enyl]-1,3-dimethylbicyclo[2.2.1]heptan-2-ol | 11379431 | Click to see CC(=CCCC1(C2CCC(C2)(C1O)C)C)CO | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| (1S,2S,3S)-3-(5-hydroxy-4-methylpent-3-enyl)-1,3-dimethylbicyclo[2.2.1]heptan-2-ol | 163051785 | Click to see | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| (1S,2S,3S)-3-[(Z)-5-hydroxy-4-methylpent-3-enyl]-1,3-dimethylbicyclo[2.2.1]heptan-2-ol | 44583952 | Click to see CC(=CCCC1(C2CCC(C2)(C1O)C)C)CO | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| 1,7-Dimethylbicyclo[2.2.1]heptan-2-ol | 5321107 | Click to see | 140.22 | unknown | via CMAUP database |
| 1,7-Dimethylbicyclo[2.2.1]heptan-2-one | 5321106 | Click to see | 138.21 | unknown | via CMAUP database |
| 2,3-Dimethyltricyclo(2.2.1.02,6)heptane-3-carboxaldehyde | 85861298 | Click to see | 150.22 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| 3-(2,3-Dimethyl-3-tricyclo[2.2.1.02,6]heptanyl)propanoic acid | 15433329 | Click to see | 194.27 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| 3-(5-Hydroxy-4-methylpent-3-enyl)-1,3-dimethylbicyclo[2.2.1]heptan-2-ol | 72824223 | Click to see | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| 5-(2,3-Dimethyl-3-tricyclo[2.2.1.02,6]heptanyl)pent-3-en-2-one | 156799554 | Click to see | 204.31 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| 7-Methyltetracyclo[6.2.1.02,7.02,10]undecane | 85861300 | Click to see CC12CCCCC13C4C3CC2C4 | 162.27 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| Bicyclo[2.2.1]heptan-2-ol, 2-methyl-3-methylene-, exo- | 162890626 | Click to see | 138.21 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| Exo-2-methyl-3-methylenebicyclo[2.2.1]heptan-2-ol | 67760064 | Click to see | 138.21 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| Norecasantalic acid | 100966488 | Click to see CC1(C2CC3C1(C3C2)C)CC(=O)O | 180.24 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| rel-(1R,2S,3S,4S)-2,3-Dimethylbicyclo[2.2.1]heptan-2-ol | 12315275 | Click to see CC1C2CCC(C2)C1(C)O | 140.22 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| Santalone | 71438766 | Click to see CC(=O)C1(C2CC3C1(C3C2)C)C | 164.24 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| Santene hydrate | 12315274 | Click to see | 140.22 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| stereoisomer of 2,3-Dimethyltricyclo(2.2.1.02,6)heptane-3-carboxylic acid | 5321816 | Click to see | 166.22 | unknown | via CMAUP database |
| Teresantalol | 578221 | Click to see CC1(C2CC3C1(C3C2)C)CO | 152.23 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| Trans-alpha-Bergamotene | 6429302 | Click to see | 204.35 | unknown | via CMAUP database |
| Tricyclo(2.2.1.02,6)heptane-3-ethanol, 2,3-dimethyl-, stereoisomer | 131752057 | Click to see | 166.26 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| Tricycloekasantalol | 130142141 | Click to see CC1(C2CC3C1(C3C2)C)CCCO | 180.29 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Iridoids and derivatives | |||||
| 2-[(1R,2R,3R,6R,7S)-2,6-dimethyl-3-tricyclo[5.2.1.02,6]decanyl]propanal | 101925674 | Click to see | 220.35 | unknown | https://doi.org/10.1002/FFJ.2730100315 |
| 2-[(1R,2R,3S,6R,7S)-2,6-dimethyl-3-tricyclo[5.2.1.02,6]decanyl]propanal | 101925675 | Click to see | 220.35 | unknown | https://doi.org/10.1002/FFJ.2730100315 |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids | |||||
| (+)-Limonene | 440917 | Click to see | 136.23 | unknown | via CMAUP database |
| Limonene, (-)- | 439250 | Click to see | 136.23 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids | |||||
| (-)-alpha-Curcumene | 442360 | Click to see | 202.33 | unknown | via CMAUP database |
| (-)-epi-beta-Santalene | 11106484 | Click to see | 204.35 | unknown | via CMAUP database |
| (+)-alpha-Santalol | 24832102 | Click to see | 220.35 | unknown | via CMAUP database |
| (1S,2R,3S,4R)-3-(5-hydroxy-4-methylpent-3-enyl)-2,3-dimethylbicyclo[2.2.1]heptan-2-ol | 163029550 | Click to see CC(=CCCC1(C2CCC(C2)C1(C)O)C)CO | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| (1S,2R,3S,4R)-3-[(Z)-5-hydroxy-4-methylpent-3-enyl]-2,3-dimethylbicyclo[2.2.1]heptan-2-ol | 11390779 | Click to see CC(=CCCC1(C2CCC(C2)C1(C)O)C)CO | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| (1S,2R,4S,7S)-7-(5-hydroxy-4-methylpent-3-enyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-ol | 162928875 | Click to see | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| (1S,2R,4S,7S)-7-[(Z)-5-hydroxy-4-methylpent-3-enyl]-1,7-dimethylbicyclo[2.2.1]heptan-2-ol | 15976818 | Click to see | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| (1S,2S,4S,7R)-7-(5-hydroxy-4-methylpent-3-enyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-ol | 162928872 | Click to see | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| (1S,2S,4S,7R)-7-[(Z)-5-hydroxy-4-methylpent-3-enyl]-1,7-dimethylbicyclo[2.2.1]heptan-2-ol | 44583953 | Click to see | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| (1S,2S,4S,7S)-7-[(Z)-5-hydroxy-4-methylpent-3-enyl]-1,7-dimethylbicyclo[2.2.1]heptan-2-ol | 162928874 | Click to see | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| (2R,6S,7S,10Z)-beta-Santala-3(15),10-dien-12-ol | 5281532 | Click to see | 220.35 | unknown |
https://doi.org/10.1111/LAM.12005 https://doi.org/10.1016/S0944-7113(11)80056-5 |
| (2Z)-2-methyl-6-[(1R)-4-methylcyclohex-3-en-1-yl]hepta-2,6-dien-1-ol | 162953998 | Click to see | 220.35 | unknown | https://doi.org/10.1021/NP040188Q |
| (3R,6E)-Nerolidol | 11241545 | Click to see | 222.37 | unknown | via CMAUP database |
| (E,6R)-2-methyl-6-(4-methylphenyl)hept-2-en-1-ol | 12313611 | Click to see | 218.33 | unknown | via CMAUP database |
| (E)-2-methyl-5-[(1R,2R,4S)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-enal | 163021376 | Click to see CC(=CCCC1(C2CCC(C2)C1=C)C)C=O | 218.33 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| (E)-2-methyl-5-[(1S,2R,4R)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-enoic acid | 11673107 | Click to see | 234.33 | unknown | via CMAUP database |
| (E)-2-methyl-5-[(1S,2S,4S)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol | 6432708 | Click to see | 220.35 | unknown | via CMAUP database |
| (E)-5-(2,3-dimethyl-3-tricyclo[2.2.1.02,6]heptanyl)-2-methylpent-2-en-1-ol;(E)-2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-2-en-1-ol | 6537105 | Click to see | 440.70 | unknown | via CMAUP database |
| (Z,6S)-2-methyl-6-(4-methylphenyl)hept-2-ene-1,6-diol | 163012497 | Click to see | 234.33 | unknown | https://doi.org/10.1021/NP040188Q |
| (Z)-2-methyl-6-(2-methyl-3-tricyclo[2.2.1.02,6]heptanyl)hept-2-en-1-ol | 5352146 | Click to see | 234.38 | unknown | via CMAUP database |
| (Z)-5-(2,3-dimethyl-3-tricyclo[2.2.1.02,6]heptanyl)-2-methylpent-2-en-1-ol;(Z)-2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-2-en-1-ol | 5351571 | Click to see | 440.70 | unknown | via CMAUP database |
| (Z)-5-[(1R,3S,6S)-2,3-dimethyl-3-tricyclo[2.2.1.02,6]heptanyl]-2-methylpent-2-en-1-ol | 25022145 | Click to see | 220.35 | unknown | https://doi.org/10.1016/S0944-7113(11)80056-5 |
| (Z)-7-Hydroxynuciferol | 11218565 | Click to see | 234.33 | unknown | via CMAUP database |
| (Z)-alpha-Santalol | 5281531 | Click to see CC(=CCCC1(C2CC3C1(C3C2)C)C)CO | 220.35 | unknown |
https://doi.org/10.1002/HLCA.19760590304 https://doi.org/10.1021/NP040188Q https://doi.org/10.1016/S0944-7113(11)80056-5 https://doi.org/10.1111/LAM.12005 |
| (Z)-Beta-Santalol | 11031396 | Click to see CC(=CCCC1(C2CCC(C2)C1=C)C)CO | 220.35 | unknown | https://doi.org/10.1021/NP040188Q |
| (Z)-Lanceol | 15560069 | Click to see CC1=CCC(CC1)C(=C)CCC=C(C)CO | 220.35 | unknown | https://doi.org/10.1021/NP040188Q |
| 1-Methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohex-1-ene | 403919 | Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C | 204.35 | unknown | via CMAUP database |
| 2-Methyl-5-(2-methyl-3-methylenebicyclo[2.2.1]hept-2-yl)-2-penten-1-ol | 60970 | Click to see CC(=CCCC1(C2CCC(C2)C1=C)C)CO | 220.35 | unknown | https://doi.org/10.1021/NP040188Q |
| 2-Methyl-5-(2-methyl-3-methylidenebicyclo[2.2.1]heptan-2-yl)pent-2-enal | 71351634 | Click to see CC(=CCCC1(C2CCC(C2)C1=C)C)C=O | 218.33 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| 2-methyl-5-[(1R,2R,4S)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol | 50909325 | Click to see | 220.35 | unknown | https://doi.org/10.1021/NP040188Q |
| 2-Methyl-6-(4-methylcyclohex-3-en-1-yl)hepta-2,6-dien-1-ol | 529890 | Click to see | 220.35 | unknown | https://doi.org/10.1021/NP040188Q |
| 2-Methyl-6-(4-methylcyclohexa-2,5-dien-1-yl)heptan-3-ol | 101614240 | Click to see | 222.37 | unknown | via CMAUP database |
| 2-Methyl-6-(4-methylphenyl)hept-2-ene-1,6-diol | 72755903 | Click to see | 234.33 | unknown | https://doi.org/10.1021/NP040188Q |
| 3-(5-Hydroxy-4-methylpent-3-enyl)-2,3-dimethylbicyclo[2.2.1]heptan-2-ol | 72828805 | Click to see | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| 4-(7-Hydroxy-6-methylhepta-1,5-dien-2-yl)-1-methylcyclohexan-1-ol | 72824224 | Click to see | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| 5-(2,3-Dimethyl-3-tricyclo[2.2.1.02,6]heptanyl)-2-methylpent-2-en-1-ol;2-methyl-5-(2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl)pent-2-en-1-ol | 61530 | Click to see CC(=CCCC1(C2CCC(C2)C1=C)C)CO.CC(=CCCC1(C2CC3C1(C3C2)C)C)CO | 440.70 | unknown | via CMAUP database |
| 5-(2,3-Dimethyltricyclo[2.2.1.0~2,6~]heptan-3-yl)-2-methylpent-2-en-1-ol | 8283 | Click to see CC(=CCCC1(C2CC3C1(C3C2)C)C)CO | 220.35 | unknown | https://doi.org/10.1021/NP040188Q |
| 5-(2,3-Dimethyltricyclo[2.2.1.0~2,6~]heptan-3-yl)-2-methylpent-2-enal | 53438990 | Click to see CC(=CCCC1(C2CC3C1(C3C2)C)C)C=O | 218.33 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| 5-[(1R,3R,6S)-2,3-dimethyl-3-tricyclo[2.2.1.02,6]heptanyl]-2-methylpent-2-en-1-ol | 162911719 | Click to see | 220.35 | unknown | https://doi.org/10.1021/NP040188Q |
| 5-[(1R,3R)-2,3-dimethyl-3-tricyclo[2.2.1.02,6]heptanyl]-2-methylpent-2-en-1-ol;2-methyl-5-[(1R,2S,4S)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol | 53488169 | Click to see | 440.70 | unknown | via CMAUP database |
| 5-[(1S,3R)-2,3-dimethyl-3-tricyclo[2.2.1.02,6]heptanyl]-2-methylpent-2-en-1-ol;2-methyl-5-[(1S,2R,4R)-2-methyl-3-methylidene-2-bicyclo[2.2.1]heptanyl]pent-2-en-1-ol | 16072318 | Click to see | 440.70 | unknown | via CMAUP database |
| 7-(5-Hydroxy-4-methylpent-3-enyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-ol | 72750961 | Click to see | 238.37 | unknown | https://doi.org/10.1021/NP040188Q |
| alpha-Farnesene-d6 | 10330772 | Click to see CC(=CCCC(=CCC=C(C)C=C)C)C | 210.39 | unknown | via CMAUP database |
| Alpha-Santaldiol | 44583958 | Click to see | 236.35 | unknown | https://doi.org/10.1021/NP040188Q |
| Alpha-Santalol | 11085337 | Click to see | 220.35 | unknown | https://doi.org/10.1021/NP040188Q |
| Beta-Bisabolene | 10104370 | Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C | 204.35 | 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-Santaldiol | 15276127 | Click to see CC1(C2CCC(C2)C1=C)CCC=C(CO)CO | 236.35 | unknown | https://doi.org/10.1021/NP040188Q |
| beta-Santalene | 10889018 | Click to see | 204.35 | unknown | via CMAUP database |
| Beta-Santalol | 6857681 | Click to see | 220.35 | unknown |
https://doi.org/10.1016/S0944-7113(11)80056-5 https://doi.org/10.1002/FFJ.2730050407 |
| d-alpha-Santalol | 5368797 | Click to see | 220.35 | unknown | via CMAUP database |
| Dihydro-alpha-santalic acid | 14467331 | Click to see | 236.35 | unknown | https://doi.org/10.1002/CHIN.199014301 |
| Norbornane, 2-methyl-3-methylene-2-(4-methyl-3-pentenyl)- | 10534 | Click to see | 204.35 | unknown | https://doi.org/10.1016/J.PHYTOCHEM.2006.09.013 |
| Npc254293 | 24832101 | Click to see | 440.70 | unknown | via CMAUP database |
| Npc255072 | 5368798 | Click to see | 220.35 | unknown | via CMAUP database |
| Npc63450 | 12315252 | Click to see | 204.35 | unknown | via CMAUP database |
| rel-(2E)-2-Methyl-5-[(1R,2R,4S)-2-methyl-3-methylenebicyclo[2.2.1]hept-2-yl]-2-penten-1-ol | 12315259 | Click to see | 220.35 | unknown | via CMAUP database |
| rel-(2E)-2-Methyl-5-[(1R,2S,4S)-2-methyl-3-methylenebicyclo[2.2.1]hept-2-yl]-2-pentenal | 163021377 | Click to see | 218.33 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| S-Curcumene | 3083834 | Click to see | 202.33 | unknown | via CMAUP database |
| Sandal | 6857559 | Click to see CC(=CCCC1(C2CC3C1(C3C2)C)C)CO | 220.35 | unknown | https://doi.org/10.1002/FFJ.2730050407 |
| Santalene (minor) | 6431197 | Click to see CC(=CCCC1(C2CCC(C2)C1=C)C)C | 204.35 | unknown | https://doi.org/10.1016/J.PHYTOCHEM.2006.09.013 |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids | |||||
| Ledum camphor | 92812 | Click to see | 222.37 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids | |||||
| 4-epi-Eremophilene | 11160025 | Click to see CC1CCC=C2C1(CC(CC2)C(=C)C)C | 204.35 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Diterpene glycosides | |||||
| Noboritomycin A | 50207 | Click to see CCOC(=O)C1C(CC(O1)C2(C(C(C3(O2)C(C=CC4(O3)C(CC(C(O4)C(C)C(=O)C(C)C(C(C)CC(C)C5=C(C(=C(C=C5)C)O)C(=O)O)O)C)C)O)C)OC)C)O | 805.00 | unknown | https://doi.org/10.1021/NP040188Q |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Diterpene lactones | |||||
| 15,16-Epoxy-neo-clerodan-1,3,13(16),14-tetraen-18,19-olide | 5317151 | Click to see | 312.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Eudesmanolides, secoeudesmanolides, and derivatives | |||||
| Santamarin | 188297 | Click to see | 248.32 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Guaianolides and derivatives | |||||
| 2-[[6-(chloromethyl)-6,7-dihydroxy-9-methyl-3-methylidene-2-oxo-4,5,6a,7,9a,9b-hexahydro-3aH-azuleno[4,5-b]furan-4-yl]oxycarbonyl]but-2-enyl 2-(hydroxymethyl)but-2-enoate | 163013324 | Click to see CC=C(CO)C(=O)OCC(=CC)C(=O)OC1CC(C2C(C=C(C2C3C1C(=C)C(=O)O3)C)O)(CCl)O | 511.00 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Xanthophylls | |||||
| 1,1'-Dihydroxy-1,1',2,2'-tetrahydrolycopene | 14502754 | Click to see | 572.90 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Lipids and lipid-like molecules / Prenol lipids / Triterpenoids | |||||
| CID 15599867 | 15599867 | Click to see CCCCCCCCCCCCCCCC(=O)OC1CCC2(C(C1(C)C)CCC3(C2CC=C4C3(CCC5(C4C(C(CC5)C)C)C)C)C)C | 665.10 | unknown | https://doi.org/10.1016/0031-9422(80)83096-2 |
| Oleanolic Acid | 10494 | Click to see | 456.70 | unknown | via CMAUP database |
| Urs-12-en-3-ol, hexadecanoate, (3)- | 10394654 | Click to see | 665.10 | unknown | https://doi.org/10.1016/0031-9422(80)83096-2 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Cucurbitacins | |||||
| [17-(6-acetyloxy-2-hydroxy-6-methyl-3-oxohept-4-en-2-yl)-2-hydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-16-yl] acetate | 3574185 | Click to see | 600.70 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 3-hydroxysteroids / 3-beta-hydroxysteroids | |||||
| (3S,4S,5S,6S,8R,9S,10R,13R,14S,15R,17R)-17-[(E,2R,5S)-7-hydroxy-5-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,4,6,15-tetrol | 163043209 | Click to see | 450.70 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Pregnane steroids / Gluco/mineralocorticoids, progestogins and derivatives | |||||
| (3S)-17-[1-(dimethylamino)ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,4-diol | 5321818 | Click to see CC(C1CCC2C1(CCC3C2CCC4C3(CCC(C4O)O)C)C)N(C)C | 363.60 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal alkaloids / Cerveratrum-type alkaloids | |||||
| (1S,2S,6S,9S,10S,11R,12S,13S,14S,15S,18S,19S,22S,23S,25R)-6,10,19-trimethyl-24-oxa-4-azaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosane-10,12,13,14,22,23-hexol | 162881092 | Click to see CC1CCC2C(C3C(CN2C1)C4CC56C(C4(C(C3O)O)O)CCC7C5(CCC(C7(O6)O)O)C)(C)O | 493.60 | unknown | https://doi.org/10.1021/NP040188Q |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alanine and derivatives | |||||
| D-Alanine | 71080 | Click to see | 89.09 | 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 | |||||
| alpha-Glycine | 5257127 | Click to see | 75.07 | 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 / L-alpha-amino acids | |||||
| (2S,3R)-2-azaniumyl-3-hydroxybutanoate | 6971019 | Click to see CC(C(C(=O)[O-])[NH3+])O | 119.12 | unknown | via CMAUP database |
| L-Arginine | 6322 | Click to see | 174.20 | unknown | via CMAUP database |
| Lysine zwitterion | 122198194 | Click to see | 146.19 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Aspartic acid and derivatives | |||||
| CID 44367445 | 44367445 | Click to see | 133.10 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Glutamic acid and derivatives | |||||
| CID 88747398 | 88747398 | Click to see | 147.13 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Histidine and derivatives | |||||
| (2S)-2-ammonio-3-(1H-imidazol-4-yl)propanoate | 6971009 | Click to see | 155.15 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Isoleucine and derivatives | |||||
| (2S,3S)-2-ammonio-3-methylpentanoate | 7043901 | Click to see | 131.17 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Leucine and derivatives | |||||
| Leucine zwitterion | 7045798 | Click to see | 131.17 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Methionine and derivatives | |||||
| (2S)-2-ammonio-4-(methylsulfanyl)butanoate | 6992087 | Click to see | 149.21 | 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 | |||||
| Phenylalanine | 6140 | Click to see C1=CC=C(C=C1)CC(C(=O)O)N | 165.19 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Proline and derivatives | |||||
| (2S)-4-hydroxypyrrolidinium-2-carboxylate | 45266637 | Click to see | 131.13 | unknown | via CMAUP database |
| (2S)-pyrrolidinium-2-carboxylate | 6971047 | Click to see | 115.13 | unknown | via CMAUP database |
| 4-Hydroxyproline | 825 | Click to see C1C(CNC1C(=O)O)O | 131.13 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1269840/ |
| Cis-4-Hydroxy-L-Proline | 440015 | Click to see | 131.13 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1269840/ |
| cis-4-Hydroxyproline | 6971054 | Click to see | 131.13 | unknown | via CMAUP database |
| trans-hydroxy-L-proline | 6971053 | Click to see | 131.13 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Serine and derivatives | |||||
| L-Serine | 5951 | Click to see | 105.09 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Tyrosine and derivatives | |||||
| (2S)-2-ammonio-3-(4-hydroxyphenyl)propanoate | 6942100 | Click to see | 181.19 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Valine and derivatives | |||||
| CID 88733505 | 88733505 | Click to see | 117.15 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Cysteine and derivatives | |||||
| Cystine, meso- | 6991966 | Click to see | 240.30 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Peptides / Dipeptides | |||||
| 2-Amino-5-[(1-carboxy-2-hydroxyethyl)amino]-5-oxopentanoic acid | 5317735 | Click to see C(CC(=O)NC(CO)C(=O)O)C(C(=O)O)N | 234.21 | unknown | via CMAUP database |
| N-desmethyl 12-hydroxy pretubulysinD | 139588365 | Click to see CCC(C)C(C(=O)NC(C(C)C)C(CC1=NC(=CS1)C(=O)NC(CC2=CC=CC=C2)CC(C)C(=O)O)O)NC(=O)C3CCCCN3C | 671.90 | unknown | https://doi.org/10.1021/NP040188Q |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters | |||||
| Ethyl Acetate | 8857 | Click to see | 88.11 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Hexacarboxylic acids and derivatives | |||||
| (1R,1'R,2R,2'R,3'S,4S,4'R,6S,7R,8R,9S)-6',11-bis[(E)-3-[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]-3-oxoprop-1-enyl]-3',9-bis(3,4-dihydroxyphenyl)-6-hydroxy-7'-oxospiro[3,5-dioxatricyclo[5.2.2.02,6]undec-10-ene-4,8'-bicyclo[2.2.2]oct-5-ene]-2',8-dicarboxylic acid | 10748664 | Click to see | 1078.90 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Tetracarboxylic acids and derivatives | |||||
| methyl 2-[2-[4,5-diacetyloxy-3-(2-hydroxy-5-oxo-2H-furan-4-yl)-3a-methyl-7-methylidene-1a,2,3,4,5,6-hexahydroindeno[1,7a-b]oxiren-6-yl]-2,6,6-trimethyl-5-oxocyclohex-3-en-1-yl]acetate | 75061294 | Click to see | 586.60 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Organic nitrogen compounds / Organonitrogen compounds / Amines / Secondary amines / Dialkylamines | |||||
| Sym-homospermidine | 368 | Click to see C(CCNCCCCN)CN | 159.27 | unknown | via CMAUP database |
| Sym-homospermidinium(3+) | 25245489 | Click to see C(CC[NH2+]CCCC[NH3+])C[NH3+] | 162.30 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclic alcohols and derivatives | |||||
| (1S,2R,4S)-5,6-dimethylbicyclo[2.2.1]hept-5-en-2-ol | 131102360 | Click to see | 138.21 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| exo-5,6-Dimethylbicyclo[2.2.1]hept-5-en-2-ol | 101407815 | Click to see CC1=C(C2CC1CC2O)C | 138.21 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds | |||||
| (2S)-6-[(1S,10R,11S,14R,15S)-11,14-dihydroxy-15-methyl-5-tricyclo[8.7.0.02,7]heptadeca-2(7),3,5-trienyl]-2-[(2S,3S,4S,6S)-4-hydroxy-2,4-dimethyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-2,3-dihydropyran-4-one | 162904519 | Click to see | 692.80 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Alpha-hydrogen aldehydes | |||||
| 3-Methylbutanal | 11552 | Click to see | 86.13 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones | |||||
| 1-Acetyl-4-methyl-1,3-cyclohexadiene | 13294398 | Click to see | 136.19 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| 2-Methyl-3-pentanone | 11265 | Click to see | 100.16 | unknown | via CMAUP database |
| 3-Methyl-2-butanone | 11251 | Click to see | 86.13 | unknown | via CMAUP database |
| Methyl Isobutyl Ketone | 7909 | Click to see | 100.16 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones / Alpha-hydroxy ketones | |||||
| Hydroxyacetone | 8299 | Click to see | 74.08 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones | |||||
| 3-Hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-1-propanone | 75142 | Click to see | 196.20 | unknown | https://doi.org/10.1248/CPB.53.641 |
| 3-Hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)propan-1-one | 54353627 | Click to see | 226.23 | unknown | https://doi.org/10.1248/CPB.53.641 |
| > Organic oxygen compounds / Organooxygen compounds / Enediols | |||||
| Dihydro-caffeic acid | 15847196 | Click to see | 182.17 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Organoheterocyclic compounds / Benzodioxanes / Phenylbenzodioxanes / Phenylbenzo-1,4-dioxanes | |||||
| (E)-3-[(2R,3R)-2-(3,4-dihydroxy-5-methoxyphenyl)-3-(hydroxymethyl)-5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl]prop-2-enal | 46193590 | Click to see | 388.40 | unknown | https://doi.org/10.1248/CPB.58.587 |
| 3-[2-(3,4-Dihydroxy-5-methoxyphenyl)-3-(hydroxymethyl)-5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl]prop-2-enal | 75169439 | Click to see | 388.40 | unknown | https://doi.org/10.1248/CPB.58.587 |
| 3-[2-(4-Hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl]prop-2-enal | 73009773 | Click to see | 402.40 | unknown | https://doi.org/10.1248/CPB.58.587 |
| 5-[(2S,3S)-3-(hydroxymethyl)-7-[(E)-3-hydroxyprop-1-enyl]-5-methoxy-2,3-dihydro-1,4-benzodioxin-2-yl]-3-methoxybenzene-1,2-diol | 11417897 | Click to see | 390.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
| 5-[3-(Hydroxymethyl)-7-(3-hydroxyprop-1-enyl)-5-methoxy-2,3-dihydro-1,4-benzodioxin-2-yl]-3-methoxybenzene-1,2-diol | 72953596 | Click to see | 390.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
| Bilagrewin | 11567569 | Click to see | 402.40 | unknown | https://doi.org/10.1248/CPB.58.587 |
| CID 85162038 | 85162038 | Click to see COC1=CC(=CC2=C1OC(C(O2)C3=CC(=C(C(=C3)OC)O)OC)CO)C=CCO | 404.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
| Nitidanin | 11188887 | Click to see | 404.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
| > Organoheterocyclic compounds / Benzodioxoles | |||||
| tsangibeilin B, rel- | 54671629 | Click to see | 350.40 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Organoheterocyclic compounds / Dihydrofurans / Furanones / Butenolides | |||||
| Dodonolide | 643656 | Click to see CC1CCC2=C(C=CC=CC1(C)CCC3=COC=C3)C(=O)OC2 | 312.40 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Heteroaromatic compounds | |||||
| Pyrrole | 8027 | Click to see | 67.09 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Indoles and derivatives | |||||
| (1R,15R)-15-methyl-16-propan-2-yl-3,14-dioxa-11-azapentacyclo[7.5.1.12,5.01,11.06,15]hexadecan-4-one | 5316539 | Click to see | 291.40 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Indoles and derivatives / Pyrroloindoles | |||||
| (1S,2S,3S,11R,14S)-3-[(1S,3R,11R,14S)-14,18-dimethyl-13,17-dioxo-15,16-dithia-10,12,18-triazapentacyclo[12.2.2.01,12.03,11.04,9]octadeca-4,6,8-trien-3-yl]-2-hydroxy-14,18-dimethyl-15,16-dithia-10,12,18-triazapentacyclo[12.2.2.01,12.03,11.04,9]octadeca-4,6,8-triene-13,17-dione | 146684982 | Click to see CC12C(=O)N3C4C(CC3(C(=O)N1C)SS2)(C5=CC=CC=C5N4)C67C(C89C(=O)N(C(C(=O)N8C6NC1=CC=CC=C71)(SS9)C)C)O | 680.80 | unknown | https://doi.org/10.1021/NP040188Q |
| > Organoheterocyclic compounds / Lactones / Gamma butyrolactones | |||||
| 4-Hydroxy-5-methyl-3-(9-phenylnonyl)oxolan-2-one | 162978688 | Click to see | 318.40 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Organoheterocyclic compounds / Naphthopyrans / Naphthopyranones | |||||
| SC-28763 | 191357 | Click to see | 646.60 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Organoheterocyclic compounds / Pyridines and derivatives / Aminopyridines and derivatives | |||||
| Dalfampridine | 1727 | Click to see C1=CN=CC=C1N | 94.11 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyridines and derivatives / Methylpyridines | |||||
| 3-Methylpyridine | 7970 | Click to see | 93.13 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyrroles / Substituted pyrroles | |||||
| 1-Ethylpyrrole | 185226 | Click to see | 95.14 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyrroles / Substituted pyrroles / N-substituted pyrroles / N-methylpyrroles | |||||
| 1-Methylpyrrole | 7304 | Click to see CN1C=CC=C1 | 81.12 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids | |||||
| (7S,8R)-Dihydrodehydrodiconiferyl Alcohol | 384679 | Click to see | 360.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
| 2-(4-Hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-7-ol | 187915 | Click to see COC1=C(C=CC(=C1)C2C(C3=C(O2)C(=CC(=C3)CCCO)O)CO)O | 346.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
| 4-[3-(Hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenol | 4365980 | Click to see COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)CCCO | 360.40 | unknown |
https://doi.org/10.1248/CPB.53.641 https://doi.org/10.1248/CPB.58.587 |
| Cedrusin | 11210164 | Click to see | 346.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
| Dihydrodehydroconiferyl alcohol, (7R,8S)-(-)- | 5274623 | Click to see COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)CCCO | 360.40 | unknown |
https://doi.org/10.1248/CPB.58.587 https://doi.org/10.1248/CPB.53.641 |
| > Phenylpropanoids and polyketides / Coumarins and derivatives / Furanocoumarins / Psoralens / 5-methoxypsoralens | |||||
| Bergapten | 2355 | Click to see COC1=C2C=CC(=O)OC2=CC3=C1C=CO3 | 216.19 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavans / 8-prenylated flavans / 8-prenylated flavanones | |||||
| CID 102004745 | 102004745 | Click to see CC(=CCC1=C(C(=C2C(=C1O)C(=O)CC(O2)C3=C(C=C(C=C3)O)O)CC(CC=C(C)C)C(=C)C)O)C | 492.60 | unknown | https://doi.org/10.1002/HLCA.19760590304 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavones | |||||
| 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 |
| 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 | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols | |||||
| Isorhamnetin | 5281654 | Click to see | 316.26 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides | |||||
| Isoorientin | 114776 | Click to see | 448.40 | unknown | via CMAUP database |
| Isovitexin | 162350 | Click to see | 432.40 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides / Flavonoid 8-C-glycosides | |||||
| 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 |
| Vicenin 2 | 442664 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C(=C3O2)C4C(C(C(C(O4)CO)O)O)O)O)C5C(C(C(C(O5)CO)O)O)O)O)O | 594.50 | unknown | via CMAUP database |
| Vitexin | 5280441 | Click to see | 432.40 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides | |||||
| Laricitrin 3-O-glucoside | 101682256 | Click to see COC1=CC(=CC(=C1O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O | 494.40 | unknown | https://doi.org/10.1021/NP040188Q |
| > Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 6-O-methylated flavonoids | |||||
| Hispidulin | 5281628 | Click to see | 300.26 | unknown | via CMAUP database |
| Jaceosidin | 5379096 | Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(O2)C=C(C(=C3O)OC)O)O | 330.29 | unknown | via CMAUP database |
| Nepetin | 5317284 | Click to see | 316.26 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids | |||||
| 4-[(2S)-5-hydroxy-7-methoxy-3,4-dihydro-2H-chromen-2-yl]benzene-1,2-diol | 53349840 | Click to see COC1=CC(=C2CCC(OC2=C1)C3=CC(=C(C=C3)O)O)O | 288.29 | unknown |
https://doi.org/10.1002/HLCA.19760590304 https://doi.org/10.1021/NP040188Q |
| Cirsiliol | 160237 | Click to see COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C=C3)O)O)O)OC | 330.29 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Isoflavonoids / Isoflav-2-enes / Isoflavones | |||||
| Orobol | 5281801 | Click to see C1=CC(=C(C=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O)O | 286.24 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins | |||||
| 4-[(2S,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-3-methoxybenzoic acid | 102208369 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=C(C=C(C=C3)C(=O)O)OC)CO)O)O)O)O)O | 476.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
| 4-[4,5-Dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-3-methoxybenzoic acid | 162953013 | Click to see | 476.40 | unknown | https://doi.org/10.1248/CPB.53.641 |
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