Nigella sativa
Details Top
| Internal ID | UUID643ff65c4ce8d925112107 |
| Scientific name | Nigella sativa |
| Authority | L. |
| First published in | Sp. Pl. : 584 (1753) |
Ethnobotanical Use Top
Suggest a correction!
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.
Traditional uses of Nigella sativa, commonly known as black‑seed, span several centuries and cultures. In the Arabian Peninsula, the seeds are steeped in hot water to produce a mild tea that is drunk for digestive comfort and to relieve coughs, as documented by Al‑Khalaf et al., 2019. In Ayurvedic practice in India, a decoction of the seeds is used as a tonic for liver health and to treat skin inflammation; this is described in the 2020 edition of the Ayurvedic Pharmacopoeia. Among the Oromo people of Ethiopia, a poultice made from ground seeds and water is applied to wounds to promote healing, a use reported by Tadesse and colleagues, 2018. In traditional Chinese medicine, the seeds are macerated in vinegar to create a tincture that is taken for menstrual cramps, as noted in the 2017 review by Li and Wang.
A simple, safe recipe for a black‑seed tea is as follows: take 1 teaspoon (≈3 g) of dried Nigella sativa seeds and add them to 1 cup (240 mL) of boiling water. Let the mixture steep for 10 minutes, then strain and sip. This preparation delivers a gentle dose of the seed’s bioactive oils while minimizing potential irritation. The tea is generally safe for most adults, but pregnant women should limit intake to no more than 1 tsp per day, as high doses may stimulate uterine contractions; consult a healthcare provider before use.
The therapeutic effects of Nigella sativa are largely attributed to its well‑established phytochemicals. Thymoquinone, the principal active compound, has strong antioxidant and anti‑inflammatory properties. Other constituents such as nigellidine, nigellicine, and p‑cymene contribute to its antimicrobial and hepatoprotective activities. These compounds have been isolated from the seed oil and are thought to underlie the plant’s traditional uses for digestive, respiratory, and skin ailments.
Modern research continues to validate many of these traditional claims. Recent clinical trials have shown that black‑seed oil can reduce blood pressure, improve glycemic control, and alleviate symptoms of allergic rhinitis. Commercially, standardized black‑seed oil supplements are widely available, and the plant remains an integral part of folk medicine in the Middle East, South Asia, and parts of Africa.
General Uses Top
Suggest a correction!Common products:
Black cumin is used primarily as a spice. The dried seeds are marketed whole or ground; the fixed oil is produced by pressing or solvent extraction from the seeds; essential oil is obtained by steam distillation of seeds or seed powder.
Industrial and craft applications:
No established industrial or craft applications beyond flavor/fragrance and related uses are documented.
Food and beverages (non-medicinal):
The seeds serve as a spice in Middle Eastern, South Asian, and Mediterranean cuisines (e.g., pickles, breads, cheeses, spice blends, and vegetable dishes). The fixed oil is used as an edible oil; typical culinary uses include salad dressings and frying where high linoleic acid content is relevant. The essential oil is used as a flavoring ingredient in foods and beverages at low levels. No health claims are made.
Colorants and tanning:
No documented uses.
Wood and fiber:
No documented uses.
Fragrance and cosmetics:
The essential oil (containing p-cymene, thymoquinone, α-pinene, and others) is used in fragrances and in cosmetics, including soaps and creams, typically as a flavor/fragrance component. The fixed oil is used in cosmetic formulations.
Properties relevant to use:
Black cumin seed fixed oil is rich in linoleic acid (typically 50–60%) with smaller amounts of oleic, palmitic, and stearic acids; it is notable for a high polyunsaturated fatty acid content and a low saturated fatty acid fraction. The essential oil typically contains p-cymene, thymoquinone, α- and β-pinene, and other monoterpenes, which contribute to its aroma.
Standards and regulation:
The seeds are recognized as Generally Recognized As Safe (GRAS) for use as a spice or flavoring in the United States (FDA 21 CFR 182.20). International specifications for the spice and its oils may be found in ISO standards; for example, ISO 7360 governs black cumin seed spice specifications.
Sustainability and sourcing:
Production is concentrated in regions such as the Mediterranean, the Middle East, South Asia, and North Africa. Primary uses are culinary and flavor/fragrance; no major sustainability frameworks are specific to this crop beyond general spice sourcing norms.
Synonyms Top
| Scientific name | Authority | First published in |
|---|---|---|
| Nigella cretica | Mill. | Gard. Dict. ed. 8 : n.º 4 (1768) |
| Nigella truncata | Viv. | Pl. Aegypt. Dec. : 6 (1830) |
| Nigella indica | Roxb. ex Flem. | Asiat. Res. 11: 173 (1810) |
| Nigella glandulifera | Freyn & Sint ex Freyn | Bull. Herb. Boissier , sér. 2, 3: 559 (1903) |
Common names Top
Add a new one! Suggest a correction!| Language | Common/alternative name |
|---|---|
| English | black caraway |
| English | black cumin |
| English | black onion seed |
| Spanish | kalonji |
| Spanish | neguilla hortense |
| Spanish | toda especia |
| Spanish | nigella cretica |
| Spanish | nigella truncata |
| ace | jeura itam |
| Amharic | ጥቁር ኣዝሙድ |
| Arabic | حبة البركة |
| Arabic | الحبة السوداء |
| Arabic | حبة سوداء |
| Arabic | حبه البركه |
| Arabic | شونيز |
| Arabic | بشمة |
| Arabic | كمون اسود |
| Assamese | ক'লা জীৰা |
| Azerbaijani | Çörəkotu |
| Azerbaijani | qara zirə |
| Azerbaijani | Əkin qaraçörəkotu |
| azb | اکین قاراچؤرک اوْتو |
| Belarusian | чарнушка |
| Belarusian | чарнушка пасяўная |
| Bulgarian | черен кимион |
| bho | मंगरइल |
| bho | कलौंजी |
| bho | मँगरइल |
| bho | मंगरैल |
| Bengali | কালো জিরা |
| Bengali | কালোজিরা |
| Bosnian | Čurekot |
| Catalan | pebreta |
| Czech | černucha setá |
| Danish | sortkommen |
| German | echter schwarzkümmel |
| German | schwarzer kümmel |
| dv | ކަޅު ދިރި |
| Greek | Νιγέλα η εδώδιμος |
| Esperanto | sema nigelo |
| Estonian | aed-mustköömen |
| Basque | usagari |
| Persian | سیاهدانه |
| Persian | سیاه دانه |
| Finnish | ryytineito |
| Finnish | maustenigella |
| French | nigelle cultivée |
| French | cumin noir |
| French | nigelle cultivee |
| Hausa | habbatus sauda |
| Hebrew | קצח תרבותי |
| Hebrew | קצח הגינה |
| Croatian | crni kim |
| Upper Sorbian | sywna čornucha |
| Hungarian | kerti katicavirág |
| hyw | Սեւագնդիկ |
| Indonesian | jintan hitam |
| Indonesian | habbatussauda |
| Italian | grano nero |
| Japanese | ニオイクロタネソウ |
| jv | jinten ireng |
| Kabyle | sanuj |
| Kazakh | Қара зере |
| Kannada | ಕರೀಜೀರಿಗೆ |
| Korean | 흑쿠민 |
| ku | reşreşk |
| Lithuanian | sėjamoji juodgrūdė |
| Lithuanian | kalondži |
| Latvian | sējas melnsēklīte |
| mad | jhinten èreng |
| Malayalam | നിഗെല്ല സറ്റൈവ |
| Malay | habbatus sawda |
| Malay | habbatussauda |
| Malay | jintan hitam |
| Malay | habbatus sauda |
| Norwegian Bokmål | svartkummen |
| Nepali | कालो जीरा |
| Dutch | zwarte komijn |
| Punjabi | ਕਲੌਂਜੀ |
| Polish | czarnuszka siewna |
| Punjab | کلونجی |
| Pashto | توره وانجه |
| Pashto | کلونجۍ |
| Pashto | توروانجه |
| Romanian | negrilică |
| Russian | Чернушка посевная |
| Russian | калинджи |
| Russian | Черный тмин |
| Russian | Чёрный тмин |
| Russian | чернушка посевная |
| Serbo-Croatian | crni kumin |
| Slovak | Černuška siata |
| Albanian | fara e zeze |
| Serbian | Чурукот |
| Swedish | svartkummin |
| Tamil | கருஞ்சீரகம் |
| Telugu | black seed |
| tg | Сиёҳдона |
| Thai | เทียนดำ |
| Turkish | çörek otu |
| Ukrainian | Калінджі |
| Ukrainian | Чорний кмин |
| Ukrainian | Чорнушка посівна |
| Urdu | کلونجی |
| vls | nigelle |
| Chinese | 家黑种草 |
| Chinese | 黑香种草(家黑种草) |
| Chinese | 黑种草 |
| Chinese | 家黑種草 |
Varieties (abbr. var.) Top
Add a new one! Suggest a correction!| Name | Authority | First published in |
|---|---|---|
| Nigella sativa var. hispidula | Boiss. | Ann. Sci. Nat., Bot. sér. 2, 16: 360. 1841 (1841) |
Germination/Propagation Top
Suggest a correction or add new data!| Sow seeds at 20°C, expecting germination within 3 months without further temperature treatment. |
Distribution (via POWO/KEW) Top
Legend for the distribution data:
- Doubtful data
- Extinct
- Introduced
- Native
-
Africa click to expand
-
Northeast Tropical Africa
- Ethiopia
- Somalia
- Sudan
-
Northern Africa
- Algeria
- Egypt
- Libya
- Morocco
- Tunisia
-
Northeast Tropical Africa
-
Asia-temperate click to expand
-
Arabian Peninsula
- Saudi Arabia
- Yemen
-
Caucasus
- North Caucasus
- Transcaucasus
-
Middle Asia
- Kazakhstan
- Kirgizstan
- Tadzhikistan
- Turkmenistan
- Uzbekistan
-
Western Asia
- Afghanistan
- Cyprus
- East Aegean Islands
- Iran
- Iraq
- Turkey
-
Arabian Peninsula
-
Asia-tropical click to expand
-
Indian Subcontinent
- Assam
- Bangladesh
- India
-
Indo-China
- Myanmar
-
Indian Subcontinent
-
Europe click to expand
-
Eastern Europe
- Central European Russia
- Krym
- Ukraine
-
Middle Europe
- Czechoslovakia
-
Southeastern Europe
- Bulgaria
- Greece
- Italy
- Romania
- Turkey-in-Europe
- Yugoslavia
-
Southwestern Europe
- France
-
Eastern Europe
Links to other databases Top
Suggest others/fix!| Database | ID/link to page |
|---|---|
| World Flora Online | wfo-0000380671 |
| UNII | 75NV8BO2KN |
| USDA Plants | NISA2 |
| Tropicos | 27100104 |
| INPN | 109638 |
| Flora of Italy | 1003 |
| KEW | urn:lsid:ipni.org:names:711687-1 |
| The Plant List | kew-2381679 |
| PFAF | Nigella sativa |
| Open Tree Of Life | 142360 |
| Observations.org | 142522 |
| NCBI Taxonomy | 555479 |
| NBN Atlas | NBNSYS0200002703 |
| IPNI | 711687-1 |
| iNaturalist | 122834 |
| GBIF | 5371700 |
| Freebase | /m/06h3pn |
| EPPO | NIGSA |
| EOL | 485246 |
| Elurikkus | 5884 |
| USDA GRIN | 25337 |
| Wikipedia | Nigella_sativa |
| CMAUP | NPO2136 |
Genomes (via NCBI) Top
No reference genome is available on NCBI yet. We are constantly monitoring for new data.
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.
If you wish to see all the related articles click here.
Phytochemical Profile Top
Add a new one!
Below are displayed the proven (via scientific papers) natural compounds!
You can also contribute to this by clicking here.
You can also contribute to this by clicking here.
| Name | PubChem ID | Canonical SMILES | MW | Found in | Proof |
|---|---|---|---|---|---|
| > Alkaloids and derivatives / Aporphines | |||||
| (6aR)-1,2-dimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-10,11-diol | 163190058 | Click to see C[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)O)O)OC)OC)C | 342.40 | unknown | https://doi.org/10.1248/CPB.52.454 |
| > Benzenoids / Benzene and substituted derivatives / Phenylpropanes | |||||
| 2-(2-Methoxypropyl)-5-methyl-1,4-benzenediol | 10012907 | Click to see CC1=CC(=C(C=C1O)CC(C)OC)O | 196.24 | unknown | https://doi.org/10.1248/BPB.24.307 |
| 2-[(2R)-2-methoxypropyl]-5-methylbenzene-1,4-diol | 162964672 | Click to see CC1=CC(=C(C=C1O)CC(C)OC)O | 196.24 | unknown | https://doi.org/10.1248/BPB.24.307 |
| > Benzenoids / Phenol ethers / Anisoles | |||||
| Anethole | 637563 | Click to see | 148.20 | unknown | https://doi.org/10.1002/1099-1573(200008)14:5<323::AID-PTR621>3.0.CO;2-Q |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids | |||||
| 9-Octadecenoic Acid | 965 | Click to see | 282.50 | unknown | https://doi.org/10.1055/S-0028-1100226 |
| Arachidonic Acid | 444899 | Click to see | 304.50 | unknown | https://doi.org/10.5962/BHL.TITLE.108605 |
| Eicosanoic Acid | 10467 | Click to see | 312.50 | unknown |
https://doi.org/10.5962/BHL.TITLE.108605 https://doi.org/10.1016/0031-9422(86)88046-3 |
| Myristic Acid | 11005 | Click to see | 228.37 | unknown |
https://doi.org/10.1016/0031-9422(86)88046-3 https://doi.org/10.1055/S-0028-1100226 |
| Oleic Acid | 445639 | Click to see | 282.50 | unknown |
https://doi.org/10.1016/0031-9422(86)88046-3 https://doi.org/10.1055/S-0028-1100226 https://doi.org/10.5962/BHL.TITLE.108605 |
| Palmitic Acid | 985 | Click to see | 256.42 | unknown |
https://doi.org/10.1016/0031-9422(86)88046-3 https://doi.org/10.1055/S-0028-1100226 |
| Palmitoleic Acid | 445638 | Click to see CCCCCCC=CCCCCCCCC(=O)O | 254.41 | unknown |
https://doi.org/10.5962/BHL.TITLE.108605 https://doi.org/10.1016/0031-9422(86)88046-3 |
| Stearic Acid | 5281 | Click to see | 284.50 | unknown |
https://doi.org/10.1016/0031-9422(86)88046-3 https://doi.org/10.1055/S-0028-1100226 |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides | |||||
| D-Glucose, 4-O-alpha-D-glucopyranosyl- | 303614 | Click to see C(C1C(C(C(C(O1)OC(C(CO)O)C(C(C=O)O)O)O)O)O)O | 342.30 | unknown | https://doi.org/10.1007/S00044-007-9080-1 |
| Glc(a1-4)aldehydo-Gal | 121434384 | Click to see | 342.30 | unknown | https://doi.org/10.1007/S00044-007-9080-1 |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters | |||||
| undecyl (4R)-4-hydroxynonanoate | 163084150 | Click to see | 328.50 | unknown | https://doi.org/10.1007/S00044-007-9080-1 |
| Undecyl 4-hydroxynonanoate | 163084149 | Click to see | 328.50 | unknown | https://doi.org/10.1007/S00044-007-9080-1 |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols | |||||
| (14R,20S)-14,20-dimethylheptacosan-1-ol | 163007538 | Click to see | 424.80 | unknown | https://doi.org/10.1007/S00044-007-9080-1 |
| 14,20-Dimethyl heptacosanol | 129883039 | Click to see | 424.80 | unknown | https://doi.org/10.1007/S00044-007-9080-1 |
| > Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives | |||||
| 9,12-Octadecadienoic Acid | 3931 | Click to see | 280.40 | unknown | https://doi.org/10.1055/S-0028-1100226 |
| 9,12,15-Octadecatrienoic acid | 860 | Click to see CCC=CCC=CCC=CCCCCCCCC(=O)O | 278.40 | unknown | https://doi.org/10.1055/S-0028-1100226 |
| Elaidolinolenic acid | 5282822 | Click to see | 278.40 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| Linoleic Acid | 5280450 | Click to see CCCCCC=CCC=CCCCCCCCC(=O)O | 280.40 | unknown |
https://doi.org/10.1016/0031-9422(86)88046-3 https://doi.org/10.1055/S-0028-1100226 https://doi.org/10.5962/BHL.TITLE.108605 |
| Linolenic Acid | 5280934 | Click to see | 278.40 | unknown |
https://doi.org/10.1016/0031-9422(86)88046-3 https://doi.org/10.5962/BHL.TITLE.108605 https://doi.org/10.1055/S-0028-1100226 |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Dolabellane and neodolabellane diterpenoids | |||||
| [(1R,2R,4S,6R,9E,11S,12S)-11-benzoyloxy-12-(benzoyloxymethyl)-15-(2-hydroperoxypropan-2-yl)-4,9-dimethyl-5-oxatricyclo[10.3.0.04,6]pentadeca-9,14-dien-2-yl] pyridine-3-carboxylate | 11181504 | Click to see CC1=CC(C2(CC=C(C2C(CC3(C(O3)CC1)C)OC(=O)C4=CN=CC=C4)C(C)(C)OO)COC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6 | 681.80 | unknown | https://doi.org/10.1021/OL036239C |
| [(1R,2R,4S,6R,9E,11S,12S)-12-(benzoyloxymethyl)-15-(2-hydroperoxypropan-2-yl)-4,9-dimethyl-11-(pyridine-3-carbonyloxy)-5-oxatricyclo[10.3.0.04,6]pentadeca-9,14-dien-2-yl] pyridine-3-carboxylate | 11296902 | Click to see | 682.80 | unknown | https://doi.org/10.1021/OL036239C |
| [(1S,2R,4S,6R,9E,11S,12S)-11-benzoyloxy-12-(benzoyloxymethyl)-4,9-dimethyl-15-propan-2-ylidene-5-oxatricyclo[10.3.0.04,6]pentadec-9-en-2-yl] pyridine-3-carboxylate | 11411178 | Click to see CC1=CC(C2(CCC(=C(C)C)C2C(CC3(C(O3)CC1)C)OC(=O)C4=CN=CC=C4)COC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6 | 649.80 | unknown | https://doi.org/10.1021/OL036239C |
| [(1S,2R,4S,6R,9E,11S,12S)-12-(benzoyloxymethyl)-4,9-dimethyl-15-propan-2-ylidene-11-(pyridine-3-carbonyloxy)-5-oxatricyclo[10.3.0.04,6]pentadec-9-en-2-yl] pyridine-3-carboxylate | 11296717 | Click to see | 650.80 | unknown | https://doi.org/10.1021/OL036239C |
| [(1S,2R,4S,6R,9E,11S,12S)-12-(butanoyloxymethyl)-4,9-dimethyl-15-propan-2-ylidene-11-(pyridine-3-carbonyloxy)-5-oxatricyclo[10.3.0.04,6]pentadec-9-en-2-yl] pyridine-3-carboxylate | 163185530 | Click to see | 616.70 | unknown | https://doi.org/10.1248/CPB.52.494 |
| [(1S,2R,4S,6R,9E,11S,12S)-12-(hexanoyloxymethyl)-4,9-dimethyl-15-propan-2-ylidene-11-(pyridine-3-carbonyloxy)-5-oxatricyclo[10.3.0.04,6]pentadec-9-en-2-yl] pyridine-3-carboxylate | 163195147 | Click to see | 644.80 | unknown | https://doi.org/10.1248/CPB.52.494 |
| [(1S,2R,4S,6R,9E,11S,12S)-4,9-dimethyl-12-[(2-phenylacetyl)oxymethyl]-15-propan-2-ylidene-11-(pyridine-3-carbonyloxy)-5-oxatricyclo[10.3.0.04,6]pentadec-9-en-2-yl] pyridine-3-carboxylate | 163193024 | Click to see | 664.80 | unknown | https://doi.org/10.1248/CPB.52.494 |
| [(1S,2R,4S,6R,9E,11S,12S)-4,9,12-trimethyl-15-propan-2-ylidene-11-(pyridine-3-carbonyloxy)-5-oxatricyclo[10.3.0.04,6]pentadec-9-en-2-yl] pyridine-3-carboxylate | 163190543 | Click to see | 530.70 | unknown | https://doi.org/10.1248/CPB.52.494 |
| [(1S,2R,4S,6R,9Z,11S,12S)-4,9,12-trimethyl-15-propan-2-ylidene-11-(pyridine-3-carbonyloxy)-5-oxatricyclo[10.3.0.04,6]pentadec-9-en-2-yl] pyridine-3-carboxylate | 101341399 | Click to see CC1=CC(C2(CCC(=C(C)C)C2C(CC3(C(O3)CC1)C)OC(=O)C4=CN=CC=C4)C)OC(=O)C5=CN=CC=C5 | 530.70 | unknown | https://doi.org/10.1002/CHIN.200437206 |
| [11-Benzoyloxy-12-(benzoyloxymethyl)-15-(2-hydroperoxypropan-2-yl)-4,9-dimethyl-5-oxatricyclo[10.3.0.04,6]pentadeca-9,14-dien-2-yl] pyridine-3-carboxylate | 74022711 | Click to see | 681.80 | unknown | https://doi.org/10.1021/OL036239C |
| [11-Benzoyloxy-12-(benzoyloxymethyl)-4,9-dimethyl-15-propan-2-ylidene-5-oxatricyclo[10.3.0.04,6]pentadec-9-en-2-yl] pyridine-3-carboxylate | 72836782 | Click to see | 649.80 | unknown | https://doi.org/10.1021/OL036239C |
| [12-(Benzoyloxymethyl)-15-(2-hydroperoxypropan-2-yl)-4,9-dimethyl-11-(pyridine-3-carbonyloxy)-5-oxatricyclo[10.3.0.04,6]pentadeca-9,14-dien-2-yl] pyridine-3-carboxylate | 72788808 | Click to see | 682.80 | unknown | https://doi.org/10.1021/OL036239C |
| [12-(Benzoyloxymethyl)-4,9-dimethyl-15-propan-2-ylidene-11-(pyridine-3-carbonyloxy)-5-oxatricyclo[10.3.0.04,6]pentadec-9-en-2-yl] pyridine-3-carboxylate | 72788699 | Click to see | 650.80 | unknown | https://doi.org/10.1021/OL036239C |
| [12-(Butanoyloxymethyl)-4,9-dimethyl-15-propan-2-ylidene-11-(pyridine-3-carbonyloxy)-5-oxatricyclo[10.3.0.04,6]pentadec-9-en-2-yl] pyridine-3-carboxylate | 85434652 | Click to see | 616.70 | unknown | https://doi.org/10.1248/CPB.52.494 |
| [12-(Hexanoyloxymethyl)-4,9-dimethyl-15-propan-2-ylidene-11-(pyridine-3-carbonyloxy)-5-oxatricyclo[10.3.0.04,6]pentadec-9-en-2-yl] pyridine-3-carboxylate | 85434651 | Click to see | 644.80 | unknown | https://doi.org/10.1248/CPB.52.494 |
| [4,9-Dimethyl-12-[(2-phenylacetyl)oxymethyl]-15-propan-2-ylidene-11-(pyridine-3-carbonyloxy)-5-oxatricyclo[10.3.0.04,6]pentadec-9-en-2-yl] pyridine-3-carboxylate | 85091236 | Click to see | 664.80 | unknown | https://doi.org/10.1248/CPB.52.494 |
| [4,9,12-Trimethyl-15-propan-2-ylidene-11-(pyridine-3-carbonyloxy)-5-oxatricyclo[10.3.0.04,6]pentadec-9-en-2-yl] pyridine-3-carboxylate | 85434653 | Click to see CC1=CC(C2(CCC(=C(C)C)C2C(CC3(C(O3)CC1)C)OC(=O)C4=CN=CC=C4)C)OC(=O)C5=CN=CC=C5 | 530.70 | unknown | https://doi.org/10.1248/CPB.52.494 |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Ileabethane, pseudopterane or nor-sandresane diterpenoids | |||||
| Nigellone | 398941 | Click to see | 328.40 | unknown |
https://doi.org/10.1080/10826079508009224 https://doi.org/10.1016/S0731-7085(98)00300-8 |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids | |||||
| Carvacrol | 10364 | Click to see CC1=C(C=C(C=C1)C(C)C)O | 150.22 | unknown |
https://doi.org/10.1002/1099-1573(200008)14:5<323::AID-PTR621>3.0.CO;2-Q https://doi.org/10.1248/BPB.24.307 |
| P-Cymene | 7463 | Click to see | 134.22 | unknown | https://doi.org/10.1002/1099-1573(200008)14:5<323::AID-PTR621>3.0.CO;2-Q |
| Thymohydroquinone | 95779 | Click to see CC1=CC(=C(C=C1O)C(C)C)O | 166.22 | unknown | https://doi.org/10.1016/S0731-7085(98)00300-8 |
| Thymol | 6989 | Click to see | 150.22 | unknown |
https://doi.org/10.1248/BPB.24.307 https://doi.org/10.1016/S0731-7085(98)00300-8 https://doi.org/10.1080/10826079508009224 |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids | |||||
| (+-)-alpha-Pinene | 6654 | Click to see | 136.23 | unknown | https://doi.org/10.1002/1099-1573(200008)14:5<323::AID-PTR621>3.0.CO;2-Q |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids | |||||
| 4-Terpineol, (+/-)- | 11230 | Click to see CC1=CCC(CC1)(C(C)C)O | 154.25 | unknown | https://doi.org/10.1002/1099-1573(200008)14:5<323::AID-PTR621>3.0.CO;2-Q |
| Limonene, (+/-)- | 22311 | Click to see CC1=CCC(CC1)C(=C)C | 136.23 | unknown | https://doi.org/10.1002/1099-1573(200008)14:5<323::AID-PTR621>3.0.CO;2-Q |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids | |||||
| (1S,2S,7S,8S)-2,6,6,9-tetramethyltricyclo[5.4.0.02,8]undec-9-ene | 91753627 | Click to see | 204.35 | unknown | https://doi.org/10.1002/1099-1573(200008)14:5<323::AID-PTR621>3.0.CO;2-Q |
| 4,8,8-Trimethyl-9-methylidenedecahydro-1,4-methanoazulene | 289151 | Click to see | 204.35 | unknown | https://doi.org/10.1002/1099-1573(200008)14:5<323::AID-PTR621>3.0.CO;2-Q |
| 5-Hydroxy-1-(7-hydroxy-6-methylhepta-2,5-dien-2-yl)-3a-methyl-1,2,3,5,6,7,9,9a-octahydrocyclopenta[b]chromen-8-one | 162916346 | Click to see | 346.50 | unknown | https://doi.org/10.1021/NP800172X |
| CID 16396350 | 16396350 | Click to see CC1(CCCC2(C3C1C(C2=C)CC3)C)C | 204.35 | unknown | https://doi.org/10.1002/1099-1573(200008)14:5<323::AID-PTR621>3.0.CO;2-Q |
| > Lipids and lipid-like molecules / Prenol lipids / Sesterterpenoids / Scalarane sesterterpenoids | |||||
| Taraxerol | 92097 | Click to see | 426.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins | |||||
| [(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2R,3R,4S,5S)-3-[(2R,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162876833 | Click to see | 1353.50 | unknown | https://doi.org/10.1016/0031-9422(88)83062-0 |
| CID 56671047 | 56671047 | Click to see | 1353.50 | unknown | https://doi.org/10.1016/0031-9422(88)83062-0 |
| methyl (4aR,5R,6aR,6aS,6bR,8aR,9R,10R,12aS,13R,14bS)-10-[(2R,3R,4S,5S,6R)-3-[(2S,3R,4R,5R,6S)-4,5-dihydroxy-6-methyl-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-hydroxy-9-(hydroxymethyl)-13-methoxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162930318 | Click to see | 973.10 | unknown | https://doi.org/10.1080/14786410801892078 |
| Methyl 10-[3-[4,5-dihydroxy-6-methyl-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-hydroxy-9-(hydroxymethyl)-13-methoxy-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate | 162930317 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3CCC4(C(C3(C)CO)CCC5(C4C(C=C6C5(CC(C7(C6CC(CC7)(C)C)C(=O)OC)O)C)OC)C)C)CO)O)O)OC8C(C(C(CO8)O)O)O)O)O | 973.10 | unknown | https://doi.org/10.1080/14786410801892078 |
| Sieboldianoside A | 57393816 | Click to see | 1353.50 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Triterpenoids | |||||
| (3S,10R,13R,14R,17R)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol | 102004740 | Click to see | 426.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| (3S,10S,17R)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol | 91744939 | Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)O)C)C)C | 426.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| (3S,5R,10R,13S,14S)-17-[(1R)-1,5-dimethylhex-4-enyl]-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol | 472759 | Click to see | 426.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| (4aS,6aR,6aS,6bR,8aS,9R,12aR,14bR)-10-[4,5-dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 137795128 | Click to see | 751.00 | unknown | https://doi.org/10.1055/S-2001-10628 |
| [(4aS,5S,6aR,6aS,6bR,8aR,9R,10S,12aS,13R,14bS)-10-[(2R,3R,4R,5S,6R)-5-[(2S,3R,4R,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-(hydroxymethyl)-13-methoxy-2,2,5,6a,6b,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen-4a-yl] acetate | 162884235 | Click to see | 971.20 | unknown | https://doi.org/10.1016/J.CARRES.2008.10.004 |
| [10-[5-[3,5-Dihydroxy-6-methyl-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-(hydroxymethyl)-13-methoxy-2,2,5,6a,6b,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen-4a-yl] acetate | 162884234 | Click to see | 971.20 | unknown | https://doi.org/10.1016/J.CARRES.2008.10.004 |
| 10-[4,5-Dihydroxy-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 267360 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3CCC4(C(C3(C)CO)CCC5(C4CC=C6C5(CCC7(C6CC(CC7)(C)C)C(=O)O)C)C)C)O)O)O)O)O | 751.00 | unknown | https://doi.org/10.1055/S-2001-10628 |
| Alpha-Hederin | 73296 | Click to see | 751.00 | unknown | https://doi.org/10.1055/S-2001-10628 |
| Beta-Amyrin | 73145 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C)C | 426.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| Hederagenin | 73299 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C2C1)C)C(=O)O)C | 472.70 | unknown | https://doi.org/10.1002/(SICI)1097-458X(199904)37:4<295::AID-MRC457>3.0.CO;2-Z |
| Lanosta-8,24-dien-3-ol | 856 | Click to see | 426.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| Oleanolic Acid | 10494 | Click to see | 456.70 | unknown | https://doi.org/10.21608/BFSA.2001.65761 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Cholestane steroids / Cholesterols and derivatives | |||||
| (3S,8R,9R,10R,13R,14R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 7055705 | Click to see | 386.70 | unknown | https://doi.org/10.1055/S-0028-1099512 |
| Cholest-5-en-3-ol | 304 | Click to see | 386.70 | unknown | https://doi.org/10.1055/S-0028-1099512 |
| Cholesterol | 5997 | Click to see | 386.70 | unknown |
https://doi.org/10.1016/0031-9422(86)88046-3 https://doi.org/10.1055/S-0028-1099512 |
| Lophenol | 160482 | Click to see CC1C(CCC2(C1CC=C3C2CCC4(C3CCC4C(C)CCCC(C)C)C)C)O | 400.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Cycloartanols and derivatives | |||||
| (3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methylhept-5-en-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol | 145925700 | Click to see | 426.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| 24-Methylene-9beta,19-cyclo-lanostan-3beta-ol | 9547213 | Click to see | 440.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| 24-Methylenecycloartanol | 94204 | Click to see | 440.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| 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/10.1016/0031-9422(86)88046-3 |
| Cycloeucalenol | 101690 | Click to see CC1C2CCC3C4(CCC(C4(CCC35C2(C5)CCC1O)C)C(C)CCC(=C)C(C)C)C | 426.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives | |||||
| (+)-Obtusifoliol | 65252 | Click to see | 426.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| (24R)-5-Ergosten-3beta-ol | 312822 | Click to see | 400.70 | unknown |
https://doi.org/10.1016/0031-9422(86)88046-3 https://doi.org/10.1055/S-0028-1099512 |
| (3S,8R,9R,10R,13R,14R,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 163015454 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 400.70 | unknown | https://doi.org/10.1055/S-0028-1099512 |
| (3S,8S,9S,14S,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 134766514 | Click to see | 400.70 | unknown |
https://doi.org/10.1016/0031-9422(86)88046-3 https://doi.org/10.1055/S-0028-1099512 |
| 24-Methylenelophenol | 5283640 | Click to see CC1C(CCC2(C1CC=C3C2CCC4(C3CCC4C(C)CCC(=C)C(C)C)C)C)O | 412.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| 4alpha,24-Dimethyl-5alpha-cholest-8(9)-en-3beta-ol | 101614264 | Click to see CC1C2CCC3=C(C2(CCC1O)C)CCC4(C3CCC4C(C)CCC(C)C(C)C)C | 414.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| Campestanol | 119394 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C | 402.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives | |||||
| (3S,10R,13R)-10,13-dimethyl-17-[(Z,2R)-5-propan-2-ylhept-5-en-2-yl]-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol | 23724575 | Click to see | 410.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| (3S,5S,9S,10S,13R,14R,17R)-17-[(E,2S,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 162958795 | Click to see | 412.70 | unknown | https://doi.org/10.1055/S-0028-1099512 |
| (3S,5S,9S,10S,13R,17R)-17-[(2R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol | 91746710 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)C(C)C | 416.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| (3S,6R)-6-[(8R,9S,10S,13R,14S,17R)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-3-propan-2-ylheptan-1-ol | 56924079 | Click to see | 416.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| (3S,8R,9R,10R,13R,14R,17R)-17-[(2R,5R)-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 | 11870456 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C | 414.70 | unknown |
https://doi.org/10.1055/S-0028-1099512 https://doi.org/10.1055/S-0028-1100226 |
| (3S,8R,9R,10R,13R,14R,17R)-17-[(E,2S,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 124762119 | Click to see | 412.70 | unknown | https://doi.org/10.1055/S-0028-1099512 |
| (5S,9S,10S,13R,14R)-17-(5-ethyl-6-methylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 137706369 | Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)O)C)C)C(C)C | 412.70 | unknown | https://doi.org/10.1055/S-0028-1099512 |
| 17-(5-ethyl-6-methylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 521229 | Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)O)C)C)C(C)C | 412.70 | unknown | https://doi.org/10.1055/S-0028-1099512 |
| 17-(5-ethyl-6-methylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 122544 | Click to see | 412.70 | unknown | https://doi.org/10.1055/S-0028-1099512 |
| 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/10.1055/S-0028-1100226 https://doi.org/10.21608/BFSA.2001.65761 https://doi.org/10.1055/S-0028-1099512 https://doi.org/10.1016/0031-9422(86)88046-3 |
| 2-[[17-(5-ethyl-6-methylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol | 73072970 | Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C | 574.80 | unknown | https://doi.org/10.1080/14786410801892078 |
| 24-Ethyllophenol | 541368 | Click to see | 428.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| alpha-Spinasterin | 5281331 | Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)O)C)C)C(C)C | 412.70 | unknown | https://doi.org/10.1055/S-0028-1099512 |
| Citrostadienol | 9548595 | Click to see | 426.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| Delta7-Avenasterol | 12795736 | Click to see CC=C(CCC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)O)C)C)C(C)C | 412.70 | unknown | https://doi.org/10.1016/0031-9422(86)88046-3 |
| Stigmast-5-en-3-ol | 22012 | Click to see | 414.70 | unknown |
https://doi.org/10.21608/BFSA.2001.65761 https://doi.org/10.1016/0031-9422(86)88046-3 https://doi.org/10.1055/S-0028-1099512 |
| Stigmasterol | 5280794 | Click to see | 412.70 | unknown |
https://doi.org/10.1055/S-0028-1099512 https://doi.org/10.1016/0031-9422(86)88046-3 |
| Stigmasterol Glucoside | 6602508 | Click to see | 574.80 | unknown | https://doi.org/10.1080/14786410801892078 |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds | |||||
| Hex-2-ulofuranosyl hexopyranoside | 1115 | Click to see C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O | 342.30 | unknown | https://doi.org/10.1007/S00044-007-9080-1 |
| Sucrose | 5988 | Click to see | 342.30 | unknown | https://doi.org/10.1007/S00044-007-9080-1 |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides | |||||
| (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-(1-methoxy-3-methyl-6,7,8,9-tetrahydropyridazino[1,2-a]indazol-10-ium-11-yl)phenoxy]oxane-3,4,5-triol | 102103091 | Click to see | 471.50 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4208670/ |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzoquinones / P-benzoquinones | |||||
| Thymoquinone | 10281 | Click to see CC1=CC(=O)C(=CC1=O)C(C)C | 164.20 | unknown |
https://doi.org/10.1002/PCA.707 https://doi.org/10.1080/10826079508010400 https://doi.org/10.1002/1099-1573(200008)14:5<323::AID-PTR621>3.0.CO;2-Q https://doi.org/10.1055/S-0028-1100266 https://doi.org/10.1080/10826079508009224 https://doi.org/10.1055/S-2006-957994 https://doi.org/10.1016/S0731-7085(98)00300-8 |
| > Organoheterocyclic compounds / Benzopyrans / 1-benzopyrans / 2,2-dimethyl-1-benzopyrans | |||||
| 2,8-Dihydro-5-hydroxy-2,2-dimethyl-6H-furo(3,4-g)-1-benzopyran-6-one | 636462 | Click to see | 232.23 | unknown | https://doi.org/10.1002/MRC.919 |
| > Organoheterocyclic compounds / Benzopyrazoles / Indazoles / Pyridazinoindazoles | |||||
| (3S)-3-hydroxy-3-methyl-11-(4-oxocyclohexa-2,5-dien-1-ylidene)-2,4,6,7,8,9-hexahydropyridazino[1,2-a]indazol-1-one | 163185263 | Click to see | 312.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4208670/ |
| [11-(4-Hydroxycyclohexa-2,5-dien-1-ylidene)-3-methyl-6,7,8,9-tetrahydropyridazino[1,2-a]indazol-1-yl] hydrogen sulfate | 163104975 | Click to see | 376.40 | unknown | https://doi.org/10.1021/NP800172X |
| [3-Methyl-11-(4-oxocyclohexa-2,5-dien-1-ylidene)-6,7,8,9-tetrahydropyridazino[1,2-a]indazol-1-yl] hydrogen sulfate | 102575929 | Click to see CC1=CC2=C(C(=C1)OS(=O)(=O)O)C(=C3C=CC(=O)C=C3)N4N2CCCC4 | 374.40 | unknown | https://doi.org/10.1021/NP800172X |
| 1-Hydroxy-11-(4-hydroxyphenyl)-3-methyl-6,7,8,9-tetrahydropyridazino[1,2-a]indazol-10-ium | 118717506 | Click to see | 295.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4208670/ |
| 1-Methoxy-3-methyl-6,7,8,9-tetrahydropyridazino[1,2-a]indazol-10-ium | 71763892 | Click to see | 217.29 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4208670/ |
| 4-(1-hydroxy-3-methyl-6,7,8,9-tetrahydropyridazino[1,2-a]indazol-11-ylidene)cyclohexa-2,5-dien-1-one | 101253695 | Click to see CC1=CC2=C(C(=C1)O)C(=C3C=CC(=O)C=C3)N4N2CCCC4 | 294.30 | unknown | via CMAUP database |
| 4-(1-Methoxy-3-methyl-6,7,8,9-tetrahydropyridazino[1,2-a]indazol-11-ylidene)cyclohexa-2,5-dien-1-one | 102103090 | Click to see | 308.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4208670/ |
| 6,7,8,9-Tetrahydro-11-(4-hydroxyphenyl)-3-methyl-1H-pyridazino(1,2-a)indazol-1-one | 136828302 | Click to see | 294.30 | unknown | https://doi.org/10.1016/0040-4039(95)00210-4 |
| Nigeglanine | 12116700 | Click to see CC1=CC(=O)C2=CN3CCCCN3C2=C1 | 202.25 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4208670/ https://doi.org/10.1248/CPB.52.454 |
| Nigellicine | 11402337 | Click to see | 246.26 | unknown |
https://doi.org/10.1016/S0040-4039(00)94904-9 https://doi.org/10.1016/0040-4039(95)00210-4 |
| > Organoheterocyclic compounds / Isoquinolines and derivatives | |||||
| 6,7-Dimethoxy-1-methylisoquinoline | 20725 | Click to see CC1=NC=CC2=CC(=C(C=C12)OC)OC | 203.24 | unknown | https://doi.org/10.1021/NP50083A020 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides | |||||
| [(2R,3S,4S,5S,6S)-6-[(2S,3S,4S,5R,6S)-2-[(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate | 162848847 | Click to see | 964.80 | unknown | https://doi.org/10.1016/S0031-9422(97)00296-3 |
| [6-[2-[2-[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate | 74943526 | Click to see | 964.80 | unknown | https://doi.org/10.1016/S0031-9422(97)00296-3 |
| 2-(3,4-Dihydroxyphenyl)-3-[(O-beta-D-glucopyranosyl-(1-->2)-O-beta-D-galactopyranosyl-(1-->2)-beta-D-glucopyranosyl)oxy]-5,7-dihydroxy-4H-1-benzopyran-4-one | 101936026 | 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)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)O)O | 788.70 | unknown | https://doi.org/10.1016/S0031-9422(97)00296-3 |
| 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxychromen-4-one | 51402807 | Click to see | 464.40 | unknown | https://doi.org/10.1016/S0031-9422(97)00296-3 |
| 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-3-((O-6-O-((2E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propen-1-yl)-beta-D-glucopyranosyl-(1->2)-O-beta-D-galactopyranosyl-(1->2)-beta-D-glucopyranosyl)oxy)-4H-1-benzopyran-4-one | 101936028 | Click to see | 964.80 | unknown | https://doi.org/10.1016/S0031-9422(97)00296-3 |
| 3-[(2S,3R,4S,5S,6S)-3-[(2S,3R,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one | 162905904 | 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)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)O | 772.70 | unknown | https://doi.org/10.1016/S0031-9422(97)00296-3 |
| 3-[(2S,3S,4S,5S,6S)-3-[(2S,3R,4S,5R,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one | 162972268 | 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)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)O)O | 788.70 | unknown | https://doi.org/10.1016/S0031-9422(97)00296-3 |
| 3-[(O-beta-D-Glucopyranosyl-(1->2)-O-beta-D-galactopyranosyl-(1->2)-beta-D-glucopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one | 16745399 | 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)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)O)O | 788.70 | unknown | https://doi.org/10.1016/S0031-9422(97)00296-3 |
| Astragalin | 5282102 | Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O | 448.40 | unknown | https://doi.org/10.1016/S0031-9422(97)00296-3 |
| Astragalin 2''-[glucosyl-(1->2)-galactoside] | 57509382 | Click to see | 772.70 | unknown | https://doi.org/10.1016/S0031-9422(97)00296-3 |
| Kaempferol 3-glucosyl-(1->2)-galactosyl-(1->2)-glucoside | 101936027 | Click to see | 772.70 | unknown | https://doi.org/10.1016/S0031-9422(97)00296-3 |
| Rutin | 5280805 | Click to see | 610.50 | unknown | https://doi.org/10.1016/S0031-9422(97)00296-3 |
| Vitamin P | 5293655 | Click to see | 610.50 | unknown | https://doi.org/10.1016/S0031-9422(97)00296-3 |
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