Senna alexandrina

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Author: Public Domain - WikiMedia
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Table of Contents
Details Top
Internal ID | UUID643fd5b39d5e6180193412 |
Scientific name | Senna alexandrina |
Authority | Mill. |
First published in | Gard. Dict. ed. 8: n.° 1 (1768) |
Description Top
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Synonyms Top
Scientific name | Authority | First published in |
---|---|---|
Cassia senna | L. | Sp. Pl.: 377 (1753) |
Cassia alexandrina | (Garsault) Thell. | Bull. Herb. Boissier Ser. II. viii. 783 (1908). |
Cassia angustifolia | M.Vahl | |
Cassia alexandrina | (Mill.) Spreng. | Bot. Gart. Halle: 21 (1800) |
Common names Top
Add a new one! Suggest a correction!Language | Common/alternative name |
---|---|
English | alexandrian senna |
English | east indian senna |
English | egyptian senna |
English | tinnevelly senna |
ace | seunamaki |
Arabic | سنا حجازي |
Arabic | سنا إسكندراني |
Arabic | سنامكا |
Arabic | سنا أكيوتيفوليا |
Arabic | سنا أكيوتوفوليا |
Arabic | سنا إسكندران |
Arabic | سنا مكي |
Azerbaijani | sivriyarpaq səna |
Azerbaijani | Şişyаrpаq sənа |
Azerbaijani | cassia acutifolia |
Azerbaijani | aleksandriya yarpağı |
azb | سیوریارپاق سنا |
Catalan | sen |
Catalan | senet de l'Índia |
German | sennes |
German | alexandrinische senna |
Persian | سنا |
Finnish | aleksandriansenna |
French | sene |
French | séné |
French | cassia acutifolia |
Hindi | सनाय |
Indonesian | jati cina |
Japanese | ソルダナ |
Japanese | センナ |
Japanese | センシノド |
Japanese | センナ茶 |
Japanese | センノシド |
Japanese | プルセニド |
Kannada | ಸೋನಾಮುಖಿ |
Korean | 센나 |
Lithuanian | siauralapė velniapupė |
Latvian | smaillapu kasija |
Malayalam | tinnevelly senna |
Malayalam | നിലവാക |
Malayalam | ചെന്നാമുക്കി |
Malayalam | ചിന്നാമുക്കി |
Malayalam | indian senna |
Malayalam | egyptian senna |
Malayalam | east indian senna |
Malayalam | alexandrian senna |
Polish | strączyniec wąskolistny |
Polish | siężybób wąskolistny |
Polish | strączyniec ostrolistny |
Polish | cassia acutifolia |
Portuguese | sene |
Russian | Александрийский лист |
Russian | cassia acutifolia |
Russian | Сенна александрийская |
Serbian | Александријска сена |
Tamil | நிலாவாரை |
Thai | มะขามแขก |
Ukrainian | Сенна |
Ukrainian | Касія |
Ukrainian | cassia acutifolia |
Ukrainian | Александрійський лист |
Ukrainian | Касія вузьколиста |
Chinese | 番瀉 |
Chinese | 番泻 |
Chinese | 番泻叶 |
Varieties (abbr. var.) Top
Add a new one! Suggest a correction!Name | Authority | First published in |
---|---|---|
Senna alexandrina var. alexandrina | Unknown | |
Senna alexandrina var. obtusata | (Brenan) Lock | Kew Bull.43: 338 (1988) |
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
-
East Tropical Africa
- Kenya
-
Northeast Tropical Africa
- Chad
- Djibouti
- Eritrea
- Ethiopia
- Socotra
- Somalia
- Sudan
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Northern Africa
- Algeria
- Egypt
-
West Tropical Africa
- Benin
- Mali
- Mauritania
- Niger
- Nigeria
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West-central Tropical Africa
- Central African Republic
- Gulf Of Guinea Islands
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East Tropical Africa
-
Asia-temperate click to expand
-
Arabian Peninsula
- Gulf States
- Oman
- Saudi Arabia
- Yemen
-
Caucasus
- Transcaucasus
-
Middle Asia
- Tadzhikistan
- Uzbekistan
-
Western Asia
- Iraq
- Palestine
- Sinai
-
Arabian Peninsula
-
Asia-tropical click to expand
-
Indian Subcontinent
- India
- Pakistan
- Sri Lanka
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Indo-China
- Myanmar
-
Indian Subcontinent
-
Northern America click to expand
-
Mexico
- Mexico Southwest
-
Mexico
-
Southern America click to expand
-
Brazil
- Brazil Northeast
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Caribbean
- Dominican Republic
- Haiti
- Leeward Islands
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Western South America
- Colombia
-
Brazil
Links to other databases Top
Suggest others/fix!Database | ID/link to page |
---|---|
World Flora Online | wfo-0000164723 |
UNII | W9ZVG188IE |
USDA Plants | SEAL5 |
Tropicos | 13032839 |
KEW | urn:lsid:ipni.org:names:518323-1 |
The Plant List | ild-1115 |
Open Tree Of Life | 822192 |
NCBI Taxonomy | 72402 |
IUCN Red List | 19375516 |
IPNI | 518323-1 |
iNaturalist | 52349 |
GBIF | 2958032 |
Freebase | /m/02pyh9h |
EPPO | CASSE |
EOL | 418313 |
USDA GRIN | 100067 |
Wikipedia | Senna_alexandrina |
CMAUP | NPO28260 |
CMAUP | NPO30811 |
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)!
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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 |
---|---|---|---|---|---|
> Benzenoids / Anthracenes | |||||
(10S)-10-[(9R)-4,5-dihydroxy-2-(hydroxymethyl)-10-oxo-9H-anthracen-9-yl]-1,8-dihydroxy-3-(hydroxymethyl)-10H-anthracen-9-one | 162883504 | Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)CO)C=C(C=C3O)CO | 510.50 | unknown | https://doi.org/10.1111/J.2042-7158.1965.TB07649.X |
(10S)-10-[(9S)-4,5-dihydroxy-2-(hydroxymethyl)-10-oxo-9H-anthracen-9-yl]-1,8-dihydroxy-3-(hydroxymethyl)-10H-anthracen-9-one | 11706168 | Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)CO)C=C(C=C3O)CO | 510.50 | unknown | via CMAUP database |
10-[4,5-dihydroxy-2-(hydroxymethyl)-10-oxo-9H-anthracen-9-yl]-1,8-dihydroxy-3-(hydroxymethyl)-10H-anthracen-9-one | 5317615 | Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)CO)C=C(C=C3O)CO | 510.50 | unknown | https://doi.org/10.1111/J.2042-7158.1965.TB07649.X |
Aloe emodin glucoside | 5458442 | Click to see C1C2=C(C(=CC=C2)O)C(=O)C3=C1C=C(C=C3O)COC4C(C(C(C(O4)O)O)O)CO | 418.40 | unknown | https://doi.org/10.1159/000139860 |
Aloin A | 12305761 | Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C(C(C(C(O4)CO)O)O)O)C=C(C=C3O)CO | 418.40 | unknown | via CMAUP database |
Emodin Bianthrone | 10097848 | Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC(=C5)C)O)C(=O)C6=C4C=C(C=C6O)O)C=C(C=C3O)O | 510.50 | unknown | via CMAUP database |
> Benzenoids / Anthracenes / Anthracenecarboxylic acids and derivatives / Anthracenecarboxylic acids | |||||
(9R)-9-[(9R)-2-carboxy-1,8-dihydroxy-10-oxo-9H-anthracen-9-yl]-4,5-dihydroxy-10-oxo-9H-anthracene-2-carboxylic acid | 162956696 | Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C=CC=C5O)C(=O)C6=C4C(=C(C=C6)C(=O)O)O)C=C(C=C3O)C(=O)O | 538.50 | unknown | https://doi.org/10.1055/S-0028-1097343 |
(9R)-9-[(9S)-2-carboxy-1,8-dihydroxy-10-oxo-9H-anthracen-9-yl]-4,5-dihydroxy-10-oxo-9H-anthracene-2-carboxylic acid | 162956695 | Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C=CC=C5O)C(=O)C6=C4C(=C(C=C6)C(=O)O)O)C=C(C=C3O)C(=O)O | 538.50 | unknown | https://doi.org/10.1055/S-0028-1097343 |
(9S,9'R)-5,5'-Bis(beta-D-glucopyranosyloxy)-9,9',10,10'-tetrahydro-4,4'-dihydroxy-2'-(hydroxymethyl)-10,10'-dioxo-9,9'-bianthracene-2-carboxylic acid | 71312556 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)CO | 848.80 | unknown | via CMAUP database |
(9S)-9-[(9R)-2-Carboxy-4-hydroxy-10-oxo-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid | 6708534 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O | 862.70 | unknown | https://doi.org/10.1002/HLCA.19490320613 |
(9S)-9-[(9S)-2-carboxy-4-hydroxy-10-oxo-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid | 6708563 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O | 862.70 | unknown |
https://doi.org/10.1248/CPB.30.1550 https://doi.org/10.1002/HLCA.19490320613 |
[9,9'-Bianthracene]-2-carboxylic acid,5,5'-bis(b-D-glucopyranosyloxy)-9,9',10,10'-tetrahydro-4,4'-dihydroxy-2'-(hydroxymethyl)-10,10'-dioxo-, (9R,9'R)-rel- | 12821233 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)CO | 848.80 | unknown | https://doi.org/10.1002/HLCA.19650480809 |
4-hydroxy-9-[4-hydroxy-2-(hydroxymethyl)-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid | 161940 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)CO | 848.80 | unknown |
https://doi.org/10.1007/BF02267704 https://doi.org/10.1016/0021-9673(96)00141-0 https://doi.org/10.1159/000139860 |
4,4',5,5'-Tetrahydroxy-10,10'-dioxo-9,9',10,10'-tetrahydro-9,9'-bianthracene-2,2'-dicarboxylic acid | 122839 | Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)C(=O)O)C=C(C=C3O)C(=O)O | 538.50 | unknown |
https://doi.org/10.1016/J.PHYMED.2007.03.008 https://doi.org/10.1055/S-2002-26738 https://doi.org/10.1159/000139860 |
4,5-Dihydroxy-7-methyl-9,10-dioxo-anthracene-2-carboxylic acid | 3009664 | Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)C(=O)O | 298.25 | unknown | via CMAUP database |
9-(2-carboxy-1,8-dihydroxy-10-oxo-9H-anthracen-9-yl)-4,5-dihydroxy-10-oxo-9H-anthracene-2-carboxylic acid | 162956694 | Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C=CC=C5O)C(=O)C6=C4C(=C(C=C6)C(=O)O)O)C=C(C=C3O)C(=O)O | 538.50 | unknown | https://doi.org/10.1055/S-0028-1097343 |
9-[(9R)-2-carboxy-4-hydroxy-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid | 53486254 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O | 862.70 | unknown | via CMAUP database |
9-[2-carboxy-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-oxalooxyoxan-2-yl]oxy-4-hydroxy-10-oxo-9H-anthracen-9-yl]-4-hydroxy-10-oxo-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracene-2-carboxylic acid | 57357348 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)OC(=O)C(=O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O | 934.80 | unknown | via CMAUP database |
9,10-dioxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracene-2-carboxylic acid | 5320960 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4OC5C(C(C(C(O5)CO)O)O)O)C(=O)O | 608.50 | unknown | via CMAUP database |
Rhein | 10168 | Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)C(=O)O | 284.22 | unknown |
https://doi.org/10.1016/0021-9673(96)00141-0 https://doi.org/10.1159/000139860 https://doi.org/10.1039/CT9130302006 https://doi.org/10.1055/S-0028-1097343 https://doi.org/10.1002/JPS.2600580211 |
Rhein 8-Glucoside | 14345558 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)C(=O)O | 446.40 | unknown | https://doi.org/10.1016/0021-9673(96)00141-0 |
Rhein-8-glucoside | 5320961 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)C(=O)O | 446.40 | unknown | https://doi.org/10.1159/000139860 |
Senna-lax | 656822 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O | 862.70 | unknown | via CMAUP database |
Sennidin A | 92826 | Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)C(=O)O)C=C(C=C3O)C(=O)O | 538.50 | unknown |
https://doi.org/10.1055/S-2002-26738 https://doi.org/10.1159/000139860 |
Sennidin B | 10459879 | Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2C4C5=C(C(=CC=C5)O)C(=O)C6=C4C=C(C=C6O)C(=O)O)C=C(C=C3O)C(=O)O | 538.50 | unknown | https://doi.org/10.1159/000139860 |
Sennoside | 5199 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O | 862.70 | unknown |
https://doi.org/10.1248/CPB.30.1550 https://doi.org/10.1055/S-2007-971666 https://doi.org/10.1002/HLCA.19490320613 |
Sennoside A | 73111 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O | 862.70 | unknown |
https://doi.org/10.1002/PCA.586 https://doi.org/10.1002/JPS.2600700704 https://doi.org/10.1159/000139860 https://doi.org/10.1016/J.PHYMED.2007.03.008 https://doi.org/10.1016/S0021-9673(00)90130-4 https://doi.org/10.1055/S-2006-957476 https://doi.org/10.1007/BF02267704 https://doi.org/10.1016/0021-9673(96)00141-0 https://doi.org/10.1002/(SICI)1099-1565(199603)7:2<73::AID-PCA289>3.0.CO;2-R |
Sennoside A, analytical standard | 16218404 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O | 862.70 | unknown | via CMAUP database |
Sennoside B | 91440 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)C(=O)O | 862.70 | unknown |
https://doi.org/10.1002/PCA.586 https://doi.org/10.1002/JPS.2600700704 https://doi.org/10.1159/000139860 https://doi.org/10.1016/J.PHYMED.2007.03.008 https://doi.org/10.1016/S0021-9673(00)90130-4 https://doi.org/10.1055/S-2006-962470 https://doi.org/10.1055/S-2006-957476 https://doi.org/10.1007/BF02267704 https://doi.org/10.1016/0021-9673(96)00141-0 https://doi.org/10.1002/(SICI)1099-1565(199603)7:2<73::AID-PCA289>3.0.CO;2-R https://doi.org/10.1055/S-2007-971666 |
Sennoside C | 46173829 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)CO | 848.80 | unknown |
https://doi.org/10.1002/HLCA.19650480809 https://doi.org/10.1007/BF02267704 https://doi.org/10.1016/0021-9673(96)00141-0 https://doi.org/10.1159/000139860 |
Sennoside D | 46173830 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)C(=O)O)C=C(C=C4O)CO | 848.80 | unknown |
https://doi.org/10.1007/BF02267704 https://doi.org/10.1016/0021-9673(96)00141-0 https://doi.org/10.1159/000139860 |
> Benzenoids / Anthracenes / Anthraquinones | |||||
1,8-Dihydroxy-3-hydroxymethylanthraquinone 8-O-b-D-glucoside | 14077415 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)CO | 432.40 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
1,8-Dihydroxy-3-methyl-4a,9a-dihydroanthracene-9,10-dione | 24867638 | Click to see CC1=CC2C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3O | 256.25 | unknown | via CMAUP database |
Aloe emodin | 10207 | Click to see C1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)CO | 270.24 | unknown |
https://doi.org/10.1016/0021-9673(96)00141-0 https://doi.org/10.1002/JPS.2600580211 https://doi.org/10.1159/000139860 |
Aloe Emodin 8-Glucoside | 126456371 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)CO | 432.40 | unknown | https://doi.org/10.1016/0021-9673(96)00141-0 |
Aloe-emodin-8-O-beta-D-glucopyranoside | 5317644 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2=O)C=C(C=C4O)CO | 432.40 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
Chrysophanic acid | 10208 | Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3O | 254.24 | unknown | via CMAUP database |
Chrysophanol 8-(6-O-galloyl-beta-D-glucopyranoside) | 5315852 | Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=CC=C3OC4C(C(C(C(O4)COC(=O)C5=CC(=C(C(=C5)O)O)O)O)O)O | 568.50 | unknown | via CMAUP database |
Physcione | 10639 | Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)OC | 284.26 | unknown | https://doi.org/10.1016/0021-9673(96)00141-0 |
> Benzenoids / Anthracenes / Anthraquinones / Hydroxyanthraquinones | |||||
1-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,8-dihydroxy-6-methylanthracene-9,10-dione | 101678891 | Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3OC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)O | 594.50 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
1-[4,5-Dihydroxy-6-(hydroxymethyl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,8-dihydroxy-6-methylanthracene-9,10-dione | 163033419 | Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3OC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)O | 594.50 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
Emodin | 3220 | Click to see CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)O | 270.24 | unknown |
https://doi.org/10.1016/0021-9673(96)00141-0 https://doi.org/10.1159/000139860 |
> Benzenoids / Benzene and substituted derivatives | |||||
Benzaldehyde, oxime, (Z)- | 5324470 | Click to see C1=CC=C(C=C1)C=NO | 121.14 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters / o-Hydroxybenzoic acid esters | |||||
Methyl Salicylate | 4133 | Click to see COC(=O)C1=CC=CC=C1O | 152.15 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives | |||||
3,4-Dihydroxybenzoate | 54675866 | Click to see C1=CC(=C(C=C1C(=O)O)O)[O-] | 153.11 | unknown | via CMAUP database |
3,4-Dihydroxybenzoic acid | 72 | Click to see C1=CC(=C(C=C1C(=O)O)O)O | 154.12 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives | |||||
Vanillic Acid | 8468 | Click to see COC1=C(C=CC(=C1)C(=O)O)O | 168.15 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / O-methoxybenzoic acids and derivatives | |||||
2-Methoxybenzoate | 6950218 | Click to see COC1=CC=CC=C1C(=O)[O-] | 151.14 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / P-methoxybenzoic acids and derivatives | |||||
2,6-Dimethyl-4-methoxybenzoic acid | 816764 | Click to see CC1=CC(=CC(=C1C(=O)O)C)OC | 180.20 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Nitrobenzoic acids and derivatives | |||||
4-Nitrobenzoate | 4419940 | Click to see C1=CC(=CC=C1C(=O)[O-])[N+](=O)[O-] | 166.11 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Salicylic acid and derivatives / Salicylic acids | |||||
Salicylate | 54675850 | Click to see C1=CC=C(C(=C1)C(=O)O)[O-] | 137.11 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives | |||||
2,3-Dimethylbenzaldehyde | 34224 | Click to see CC1=C(C(=CC=C1)C=O)C | 134.17 | unknown | via CMAUP database |
4-(Dimethylamino)Benzaldehyde | 7479 | Click to see CN(C)C1=CC=C(C=C1)C=O | 149.19 | unknown | via CMAUP database |
Benzaldehyde | 240 | Click to see C1=CC=C(C=C1)C=O | 106.12 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzyloxycarbonyls | |||||
Benzyl acetate | 8785 | Click to see CC(=O)OCC1=CC=CC=C1 | 150.17 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Halobenzenes / Chlorobenzenes / Dichlorobenzenes | |||||
1,4-Dichlorobenzene | 4685 | Click to see C1=CC(=CC=C1Cl)Cl | 147.00 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Nitrobenzenes | |||||
Methyl 2-(2-nitrophenyl)acetate | 520464 | Click to see COC(=O)CC1=CC=CC=C1[N+](=O)[O-] | 195.17 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Phenylpropenes | |||||
1-Methyl-4-(prop-1-en-2-yl)benzene | 62385 | Click to see CC1=CC=C(C=C1)C(=C)C | 132.20 | unknown | via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Toluenes | |||||
Toluene | 1140 | Click to see CC1=CC=CC=C1 | 92.14 | unknown | via CMAUP database |
> Benzenoids / Naphthalenes | |||||
1,2-Dimethylnaphthalene | 11317 | Click to see CC1=C(C2=CC=CC=C2C=C1)C | 156.22 | unknown | via CMAUP database |
> Benzenoids / Naphthalenes / Naphthols and derivatives | |||||
1-(1-Hydroxy-6,8-dimethoxy-3-methylnaphthalen-2-yl)ethan-1-one | 12478854 | Click to see CC1=CC2=CC(=CC(=C2C(=C1C(=O)C)O)OC)OC | 260.28 | unknown | via CMAUP database |
> Benzenoids / Phenol ethers / Anisoles | |||||
Anethole | 637563 | Click to see CC=CC1=CC=C(C=C1)OC | 148.20 | unknown | https://doi.org/10.1055/S-2006-957965 |
Anethole, (Z)- | 1549040 | Click to see CC=CC1=CC=C(C=C1)OC | 148.20 | unknown | via CMAUP database |
Estragole | 8815 | Click to see COC1=CC=C(C=C1)CC=C | 148.20 | unknown | https://doi.org/10.1055/S-2006-957965 |
> Benzenoids / Phenols / Methoxyphenols | |||||
2-Methoxy-4-vinylphenol | 332 | Click to see COC1=C(C=CC(=C1)C=C)O | 150.17 | unknown | via CMAUP database |
Eugenol | 3314 | Click to see COC1=C(C=CC(=C1)CC=C)O | 164.20 | unknown | via CMAUP database |
> Benzenoids / Pyrenes | |||||
Hexacyclo[16.3.1.02,7.08,21.011,20.014,19]docosa-1(22),2,4,6,8(21),9,11(20),12,14,16,18-undecaen-16-ol | 152186 | Click to see C1=CC=C2C(=C1)C3=C4C2=CC5=C6C4=C(C=CC6=CC(=C5)O)C=C3 | 292.30 | unknown | via CMAUP database |
> Hydrocarbons / Saturated hydrocarbons / Alkanes | |||||
Decane | 15600 | Click to see CCCCCCCCCC | 142.28 | unknown | via CMAUP database |
Docosane | 12405 | Click to see CCCCCCCCCCCCCCCCCCCCCC | 310.60 | unknown | via CMAUP database |
Eicosane | 8222 | Click to see CCCCCCCCCCCCCCCCCCCC | 282.50 | unknown | via CMAUP database |
Heneicosane | 12403 | Click to see CCCCCCCCCCCCCCCCCCCCC | 296.60 | unknown | via CMAUP database |
Heptacosane | 11636 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCCC | 380.70 | unknown | https://doi.org/10.1055/S-2006-957965 |
Heptadecane | 12398 | Click to see CCCCCCCCCCCCCCCCC | 240.50 | unknown | via CMAUP database |
Hexacosane | 12407 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCCC | 366.70 | unknown | via CMAUP database |
Octadecane | 11635 | Click to see CCCCCCCCCCCCCCCCCC | 254.50 | unknown | via CMAUP database |
Pentacosane | 12406 | Click to see CCCCCCCCCCCCCCCCCCCCCCCCC | 352.70 | unknown | via CMAUP database |
Pentadecane | 12391 | Click to see CCCCCCCCCCCCCCC | 212.41 | unknown | via CMAUP database |
Tetracosane | 12592 | Click to see CCCCCCCCCCCCCCCCCCCCCCCC | 338.70 | unknown | via CMAUP database |
Tricosane | 12534 | Click to see CCCCCCCCCCCCCCCCCCCCCCC | 324.60 | unknown | via CMAUP database |
Tridecane | 12388 | Click to see CCCCCCCCCCCCC | 184.36 | unknown | via CMAUP database |
Undecane | 14257 | Click to see CCCCCCCCCCC | 156.31 | unknown | via CMAUP database |
> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons | |||||
gamma-Terpinene | 7461 | Click to see CC1=CCC(=CC1)C(C)C | 136.23 | unknown | via CMAUP database |
> Lignans, neolignans and related compounds / Lignan glycosides | |||||
(+)-7-epi-Syringaresinol 4'-glucoside | 4486984 | Click to see COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)OC5C(C(C(C(O5)CO)O)O)O)OC | 580.60 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
(2S,3R,4S,5S,6R)-2-[4-[[(3R,4S,5R)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-4-(hydroxymethyl)oxolan-3-yl]methyl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol | 57395552 | Click to see COC1=C(C=CC(=C1)CC2(COC(C2CO)C3=CC(=C(C=C3)O)OC)O)OC4C(C(C(C(O4)CO)O)O)O | 538.50 | unknown | via CMAUP database |
Episyringaresinol 4'-O-beta-D-glncopyranoside | 45482321 | Click to see COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)OC5C(C(C(C(O5)CO)O)O)O)OC | 580.60 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Fatty acid methyl esters | |||||
9-Octadecenoic acid, methyl ester | 8202 | Click to see CCCCCCCCC=CCCCCCCCC(=O)OC | 296.50 | unknown | via CMAUP database |
Methyl elaidate | 5280590 | Click to see CCCCCCCCC=CCCCCCCCC(=O)OC | 296.50 | unknown | via CMAUP database |
Methyl oleate | 5364509 | Click to see CCCCCCCCC=CCCCCCCCC(=O)OC | 296.50 | unknown | via CMAUP database |
Methyl palmitate | 8181 | Click to see CCCCCCCCCCCCCCCC(=O)OC | 270.50 | unknown | via CMAUP database |
Methyl Stearate | 8201 | Click to see CCCCCCCCCCCCCCCCCC(=O)OC | 298.50 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids | |||||
(9Z)-12-hydroxyoctadec-9-enoic acid | 5282942 | Click to see CCCCCCC(CC=CCCCCCCCC(=O)O)O | 298.50 | unknown | via CMAUP database |
9-Octadecenoic acid | 965 | Click to see CCCCCCCCC=CCCCCCCCC(=O)O | 282.50 | unknown | via CMAUP database |
Elaidic Acid | 637517 | Click to see CCCCCCCCC=CCCCCCCCC(=O)O | 282.50 | unknown | via CMAUP database |
Heptadecanoic acid | 10465 | Click to see CCCCCCCCCCCCCCCCC(=O)O | 270.50 | unknown | via CMAUP database |
Myristic Acid | 11005 | Click to see CCCCCCCCCCCCCC(=O)O | 228.37 | unknown | https://doi.org/10.1055/S-2006-957965 |
Oleic Acid | 445639 | Click to see CCCCCCCCC=CCCCCCCCC(=O)O | 282.50 | unknown | https://doi.org/10.1055/S-2006-957965 |
Palmitic Acid | 985 | Click to see CCCCCCCCCCCCCCCC(=O)O | 256.42 | unknown |
https://doi.org/10.1039/CT9130302006 https://doi.org/10.1055/S-2006-957965 |
Pentadecanoic Acid | 13849 | Click to see CCCCCCCCCCCCCCC(=O)O | 242.40 | unknown | via CMAUP database |
Stearic Acid | 5281 | Click to see CCCCCCCCCCCCCCCCCC(=O)O | 284.50 | unknown | via CMAUP database |
Tridecanoic acid | 12530 | Click to see CCCCCCCCCCCCC(=O)O | 214.34 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids | |||||
Capric Acid | 2969 | Click to see CCCCCCCCCC(=O)O | 172.26 | unknown | via CMAUP database |
Caproic Acid | 8892 | Click to see CCCCCC(=O)O | 116.16 | unknown | via CMAUP database |
Heptanoic Acid | 8094 | Click to see CCCCCCC(=O)O | 130.18 | unknown | via CMAUP database |
Lauric Acid | 3893 | Click to see CCCCCCCCCCCC(=O)O | 200.32 | unknown | https://doi.org/10.1055/S-2006-957965 |
Nonanoic Acid | 8158 | Click to see CCCCCCCCC(=O)O | 158.24 | unknown | via CMAUP database |
Octanoic Acid | 379 | Click to see CCCCCCCC(=O)O | 144.21 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols | |||||
(3R)-oct-1-en-3-ol | 6992244 | Click to see CCCCCC(C=C)O | 128.21 | unknown | via CMAUP database |
(S)-1-Octen-3-ol | 2724898 | Click to see CCCCCC(C=C)O | 128.21 | unknown | via CMAUP database |
1-Hexanol | 8103 | Click to see CCCCCCO | 102.17 | unknown | via CMAUP database |
1-Octanol | 957 | Click to see CCCCCCCCO | 130.23 | unknown | via CMAUP database |
1-Octen-3-Ol | 18827 | Click to see CCCCCC(C=C)O | 128.21 | unknown | via CMAUP database |
2-Ethylhexan-1-ol | 7720 | Click to see CCCCC(CC)CO | 130.23 | unknown | via CMAUP database |
Nonan-1-ol | 8914 | Click to see CCCCCCCCCO | 144.25 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives | |||||
Elaidolinolenic acid | 5282822 | Click to see CCC=CCC=CCC=CCCCCCCCC(=O)O | 278.40 | unknown | https://doi.org/10.1055/S-2006-957965 |
Linoleic Acid | 5280450 | Click to see CCCCCC=CCC=CCCCCCCCC(=O)O | 280.40 | unknown | https://doi.org/10.1055/S-2006-957965 |
Linolenic Acid | 5280934 | Click to see CCC=CCC=CCC=CCCCCCCCC(=O)O | 278.40 | unknown | https://doi.org/10.1055/S-2006-957965 |
Methyl elaidolinolenate | 5367462 | Click to see CCC=CCC=CCC=CCCCCCCCC(=O)OC | 292.50 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids | |||||
(E)-(7R,11R)-3,7,11,15-tetramethylhexadec-2-ene-1-ol | 145386 | Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C | 296.50 | unknown | via CMAUP database |
3,7,11,15-Tetramethyl-2-hexadecen-1-OL | 5366244 | Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C | 296.50 | unknown | https://doi.org/10.1055/S-2006-957965 |
3,7,11,15-Tetramethylhexadec-2-EN-1-YL acetate | 6428538 | Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCOC(=O)C)C | 338.60 | unknown | via CMAUP database |
Benzoicacidcyanomethylester | 5320547 | Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C | 296.50 | unknown | via CMAUP database |
cis-Phytol | 6430833 | Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C | 296.50 | unknown | via CMAUP database |
Phytol | 5280435 | Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C | 296.50 | unknown | https://doi.org/10.1055/S-2006-957965 |
Phytol [FHFI] | 9018 | Click to see CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C | 296.50 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids | |||||
Geranylacetone | 1549778 | Click to see CC(=CCCC(=CCCC(=O)C)C)C | 194.31 | unknown | https://doi.org/10.1055/S-2006-957965 |
Isogeraniol | 5362876 | Click to see CC(=CCC=C(C)CCO)C | 154.25 | unknown | via CMAUP database |
Linalool, (-)- | 443158 | Click to see CC(=CCCC(C)(C=C)O)C | 154.25 | unknown | via CMAUP database |
Linalool, (+)- | 67179 | Click to see CC(=CCCC(C)(C=C)O)C | 154.25 | unknown | via CMAUP database |
Linalool, (+/-)- | 6549 | Click to see CC(=CCCC(C)(C=C)O)C | 154.25 | unknown | https://doi.org/10.1055/S-2006-957965 |
Myrcene | 31253 | Click to see CC(=CCCC(=C)C=C)C | 136.23 | unknown | via CMAUP database |
Pseudoionone | 1757003 | Click to see CC(=CCCC(=CC=CC(=O)C)C)C | 192.30 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids | |||||
Carvacrol | 10364 | Click to see CC1=C(C=C(C=C1)C(C)C)O | 150.22 | unknown | via CMAUP database |
p-CYMENE | 7463 | Click to see CC1=CC=C(C=C1)C(C)C | 134.22 | unknown | via CMAUP database |
Thymol | 6989 | Click to see CC1=CC(=C(C=C1)C(C)C)O | 150.22 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids | |||||
(-)-(1S,4S)-Borneol | 6850744 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
(-)-3-Carene | 442461 | Click to see CC1=CCC2C(C1)C2(C)C | 136.23 | unknown | via CMAUP database |
(-)-Camphene | 440966 | Click to see CC1(C2CCC(C2)C1=C)C | 136.23 | unknown | via CMAUP database |
(-)-Camphor | 444294 | Click to see CC1(C2CCC1(C(=O)C2)C)C | 152.23 | unknown | via CMAUP database |
(-)-Fenchone | 82229 | Click to see CC1(C2CCC(C2)(C1=O)C)C | 152.23 | unknown | via CMAUP database |
(-)-Sabinene | 11051711 | Click to see CC(C)C12CCC(=C)C1C2 | 136.23 | unknown | via CMAUP database |
(+)-3-Carene | 443156 | Click to see CC1=CCC2C(C1)C2(C)C | 136.23 | unknown | via CMAUP database |
(+)-alpha-Pinene | 82227 | Click to see CC1=CCC2CC1C2(C)C | 136.23 | unknown | via CMAUP database |
(+)-alpha-Thujone | 12304612 | Click to see CC1C2CC2(CC1=O)C(C)C | 152.23 | unknown | via CMAUP database |
(+)-Bornyl acetate | 6950274 | Click to see CC(=O)OC1CC2CCC1(C2(C)C)C | 196.29 | unknown | via CMAUP database |
(+)-Camphene | 92221 | Click to see CC1(C2CCC(C2)C1=C)C | 136.23 | unknown | via CMAUP database |
(+)-Fenchone | 1201521 | Click to see CC1(C2CCC(C2)(C1=O)C)C | 152.23 | unknown | via CMAUP database |
(1R,2S,4R)-(+)-Bornyl acetate | 443131 | Click to see CC(=O)OC1CC2CCC1(C2(C)C)C | 196.29 | unknown | via CMAUP database |
(1R,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-OL | 12242824 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
(1S,2R,4S)-(-)-Bornyl acetate | 442460 | Click to see CC(=O)OC1CC2CCC1(C2(C)C)C | 196.29 | unknown | via CMAUP database |
(1S,2S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol | 12242815 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
(1S)-1,3,3-Trimethylbicyclo[2.2.1]heptan-2-one | 12049113 | Click to see CC1(C2CCC(C2)(C1=O)C)C | 152.23 | unknown | via CMAUP database |
(1S)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene | 12223113 | Click to see CC1=CCC2CC1C2(C)C | 136.23 | unknown | via CMAUP database |
(2S,4R)-1,7,7-Trimethylbicyclo[2.2.1]heptan-2-yl acetate | 44630108 | Click to see CC(=O)OC1CC2CCC1(C2(C)C)C | 196.29 | unknown | via CMAUP database |
(4R)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-one | 16213045 | Click to see CC1(C2CCC(C2)(C1=O)C)C | 152.23 | unknown | via CMAUP database |
(R)-Fenchone; L-(-)-Fenchone; L-Fenchone; l-Fenchone | 2794921 | Click to see CC1(C2CCC(C2)(C1=O)C)C | 152.23 | unknown | via CMAUP database |
1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol | 64685 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
3-Carene | 26049 | Click to see CC1=CCC2C(C1)C2(C)C | 136.23 | unknown | via CMAUP database |
alpha-PINENE | 6654 | Click to see CC1=CCC2CC1C2(C)C | 136.23 | unknown | via CMAUP database |
alpha-Thujone | 12304613 | Click to see CC1C2CC2(CC1=O)C(C)C | 152.23 | unknown | via CMAUP database |
beta-Pinene | 14896 | Click to see CC1(C2CCC(=C)C1C2)C | 136.23 | unknown | via CMAUP database |
Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, exo- | 439569 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
Borneol | 6552009 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
Borneol, (-)- | 1201518 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
Bornyl acetate | 6448 | Click to see CC(=O)OC1CC2CCC1(C2(C)C)C | 196.29 | unknown | via CMAUP database |
Bornyl acetate, (-)- | 93009 | Click to see CC(=O)OC1CC2CCC1(C2(C)C)C | 196.29 | unknown | via CMAUP database |
Camphene | 6616 | Click to see CC1(C2CCC(C2)C1=C)C | 136.23 | unknown | via CMAUP database |
Camphor | 2537 | Click to see CC1(C2CCC1(C(=O)C2)C)C | 152.23 | unknown | via CMAUP database |
Camphor (synthetic) | 159055 | Click to see CC1(C2CCC1(C(=O)C2)C)C | 152.23 | unknown | via CMAUP database |
Camphor, (1S,4S)-(-)- | 10050 | Click to see CC1(C2CCC1(C(=O)C2)C)C | 152.23 | unknown | via CMAUP database |
CID 44630107 | 44630107 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
d-2-Bornanone | 9543187 | Click to see CC1(C2CCC1(C(=O)C2)C)C | 152.23 | unknown | via CMAUP database |
d-Camphor | 230921 | Click to see CC1(C2CCC1(C(=O)C2)C)C | 152.23 | unknown | via CMAUP database |
DL-2-Bornanol | 10049 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
DL-Borneol | 10492 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
endo-2-Bornanol | 439568 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
Fenchone | 14525 | Click to see CC1(C2CCC(C2)(C1=O)C)C | 152.23 | unknown | via CMAUP database |
Sabinen | 18818 | Click to see CC(C)C12CCC(=C)C1C2 | 136.23 | unknown | via CMAUP database |
Sabinene | 10887971 | Click to see CC(C)C12CCC(=C)C1C2 | 136.23 | unknown | via CMAUP database |
Sumatra camphor | 657014 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids | |||||
(-)-alpha-Terpineol | 443162 | Click to see CC1=CCC(CC1)C(C)(C)O | 154.25 | unknown | via CMAUP database |
(-)-Neomenthol | 6566020 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | via CMAUP database |
(-)-Pulegone | 638012 | Click to see CC1CCC(=C(C)C)C(=O)C1 | 152.23 | unknown | via CMAUP database |
(+) Menthol | 12285346 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | via CMAUP database |
(+)-alpha-Phellandrene | 443160 | Click to see CC1=CCC(C=C1)C(C)C | 136.23 | unknown | via CMAUP database |
(+)-Isomenthone | 70962 | Click to see CC1CCC(C(=O)C1)C(C)C | 154.25 | unknown | via CMAUP database |
(+)-Menthol | 165675 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | via CMAUP database |
(+)-Menthone | 443159 | Click to see CC1CCC(C(=O)C1)C(C)C | 154.25 | unknown | https://doi.org/10.1055/S-2006-957965 |
(+)-Neomenthol | 439263 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | via CMAUP database |
(+)-Piperitone | 61362 | Click to see CC1=CC(=O)C(CC1)C(C)C | 152.23 | unknown | via CMAUP database |
(1S,2R,5S)-2-isopropyl-5-methylcyclohexyl acetate | 62335 | Click to see CC1CCC(C(C1)OC(=O)C)C(C)C | 198.30 | unknown | https://doi.org/10.1055/S-2006-957965 |
4-Terpineol, (+/-)- | 11230 | Click to see CC1=CCC(CC1)(C(C)C)O | 154.25 | unknown | https://doi.org/10.1055/S-2006-957965 |
alpha-PHELLANDRENE | 7460 | Click to see CC1=CCC(C=C1)C(C)C | 136.23 | unknown | via CMAUP database |
alpha-Terpinene | 7462 | Click to see CC1=CC=C(CC1)C(C)C | 136.23 | unknown | via CMAUP database |
Alpha-Terpineol | 17100 | Click to see CC1=CCC(CC1)C(C)(C)O | 154.25 | unknown | via CMAUP database |
Beta-Phellandrene | 11142 | Click to see CC(C)C1CCC(=C)C=C1 | 136.23 | unknown | via CMAUP database |
Carvone, (-)- | 439570 | Click to see CC1=CCC(CC1=O)C(=C)C | 150.22 | unknown | via CMAUP database |
Carvone, (+)- | 16724 | Click to see CC1=CCC(CC1=O)C(=C)C | 150.22 | unknown | https://doi.org/10.1055/S-2006-957965 |
Carvone, (+/-)- | 7439 | Click to see CC1=CCC(CC1=O)C(=C)C | 150.22 | unknown | https://doi.org/10.1055/S-2006-957965 |
Isomenthone, (+/-)- | 6432469 | Click to see CC1CCC(C(=O)C1)C(C)C | 154.25 | unknown | via CMAUP database |
l-Menthol | 16666 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | via CMAUP database |
l-Menthyl propionate | 221455 | Click to see CCC(=O)OC1CC(CCC1C(C)C)C | 212.33 | unknown | via CMAUP database |
l-Piperitone | 107561 | Click to see CC1=CC(=O)C(CC1)C(C)C | 152.23 | unknown | via CMAUP database |
Limonene, (-)- | 439250 | Click to see CC1=CCC(CC1)C(=C)C | 136.23 | unknown | via CMAUP database |
Limonene, (+)- | 440917 | Click to see CC1=CCC(CC1)C(=C)C | 136.23 | unknown | via CMAUP database |
Limonene, (+/-)- | 22311 | Click to see CC1=CCC(CC1)C(=C)C | 136.23 | unknown | https://doi.org/10.1055/S-2006-957965 |
Menthol | 1254 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | https://doi.org/10.1055/S-2006-957965 |
Menthone | 26447 | Click to see CC1CCC(C(=O)C1)C(C)C | 154.25 | unknown | via CMAUP database |
Menthyl acetate | 27867 | Click to see CC1CCC(C(C1)OC(=O)C)C(C)C | 198.30 | unknown | https://doi.org/10.1055/S-2006-957965 |
Neomenthol | 19243 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | via CMAUP database |
p-Menth-4(8)-en-3-one | 6988 | Click to see CC1CCC(=C(C)C)C(=O)C1 | 152.23 | unknown | via CMAUP database |
p-Menthan-3-one | 6986 | Click to see CC1CCC(C(=O)C1)C(C)C | 154.25 | unknown | https://doi.org/10.1055/S-2006-957965 |
Piperitone | 6987 | Click to see CC1=CC(=O)C(CC1)C(C)C | 152.23 | unknown | via CMAUP database |
Pulegone | 442495 | Click to see CC1CCC(=C(C)C)C(=O)C1 | 152.23 | unknown | via CMAUP database |
Terpinolene | 11463 | Click to see CC1=CCC(=C(C)C)CC1 | 136.23 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids | |||||
(+)-Longicyclene | 16217633 | Click to see CC1(CCCC2(C3C1C4C2(C4C3)C)C)C | 204.35 | unknown | via CMAUP database |
(+)-Longicyclene, >=95.0% (sum of enantiomers, GC) | 71311545 | Click to see CC1(CCCC2(C3C1C4C2(C4C3)C)C)C | 204.35 | unknown | via CMAUP database |
(+)-Longifolene | 1796220 | Click to see CC1(CCCC2(C3C1C(C2=C)CC3)C)C | 204.35 | unknown | via CMAUP database |
(+)-Nerolidol | 5356544 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
(+)(-)-(E)-beta-caryophyllene | 14757966 | Click to see CC1(CC2C1CCC(=C)CCCC2=C)C | 204.35 | unknown | via CMAUP database |
(1S,7S)-3,3,7-trimethyl-8-methylidenetricyclo[5.4.0.02,9]undecane | 10137 | Click to see CC1(CCCC2(C3C1C(C2=C)CC3)C)C | 204.35 | unknown | via CMAUP database |
(3R,6E)-nerolidol | 11241545 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
(3S,6E)-Nerolidol | 5281525 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
(9S)-2,6,6,9-tetramethyltetracyclo[5.4.0.02,9.08,10]undecane | 75530194 | Click to see CC1(CCCC2(C3C1C4C2(C4C3)C)C)C | 204.35 | unknown | via CMAUP database |
(E)-beta-farnesene | 10407 | Click to see CC(=CCCC(=CCCC(=C)C=C)C)C | 204.35 | unknown | via CMAUP database |
(Z)-caryophyllene | 6429301 | Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C | 204.35 | unknown | via CMAUP database |
1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, (3R,6Z)- | 12227246 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
4,11,11-Trimethyl-8-methylene-5-oxatricyclo(8.2.0.0(4,6))dodecane, (1R,4R,6R,10S)- | 6604672 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | via CMAUP database |
6,10,14-Trimethylpentadecan-2-one | 10408 | Click to see CC(C)CCCC(C)CCCC(C)CCCC(=O)C | 268.50 | unknown | via CMAUP database |
alpha-Curcumene | 92139 | Click to see CC1=CC=C(C=C1)C(C)CCC=C(C)C | 202.33 | unknown | via CMAUP database |
beta-CARYOPHYLLENE OXIDE | 1742210 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | via CMAUP database |
beta-Farnesene | 5281517 | Click to see CC(=CCCC(=CCCC(=C)C=C)C)C | 204.35 | unknown | via CMAUP database |
beta-Farnesene, (6Z)- | 5317319 | Click to see CC(=CCCC(=CCCC(=C)C=C)C)C | 204.35 | unknown | via CMAUP database |
beta-Ionone | 638014 | Click to see CC1=C(C(CCC1)(C)C)C=CC(=O)C | 192.30 | unknown | https://doi.org/10.1055/S-2006-957965 |
Caryophyllene | 5281515 | Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C | 204.35 | unknown | via CMAUP database |
Caryophyllene epoxide | 14350 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | via CMAUP database |
Caryophyllene oxide 2 | 13240188 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | via CMAUP database |
Caryophyllene,alpha + beta mixt. | 5354499 | Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C | 204.35 | unknown | via CMAUP database |
cis-Nerolidol | 5320128 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
delta-Cadinene | 12306054 | Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C | 204.35 | unknown | via CMAUP database |
Humulene | 5281520 | Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C | 204.35 | unknown | via CMAUP database |
Isocaryophyllene oxide | 1742211 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | via CMAUP database |
Longicyclene | 564934 | Click to see CC1(CCCC2(C3C1C4C2(C4C3)C)C)C | 204.35 | unknown | via CMAUP database |
Longifolene | 289151 | Click to see CC1(CCCC2(C3C1C(C2=C)CC3)C)C | 204.35 | unknown | via CMAUP database |
Naphthalene, 1,2,3,5,6,8a-hexahydro-4,7-dimethyl-1-(1-methylethyl)-, (1S-cis)- | 12306059 | Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C | 204.35 | unknown | via CMAUP database |
Nerolidol | 8888 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
trans-Nerolidol | 5284507 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins | |||||
(2S,3S,4S,5R,6R)-6-[(3R,4S,5R,6S)-6-[(2R,3R,4S,5R,6R)-2-[[(2R,3R,4S,4aR,6aR,6bS,8R,8aR,11S,12aS,14aR,14bR)-8a-carboxy-2,8-dihydroxy-4,11-bis(hydroxymethyl)-4,6a,6b,11,14b-pentamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid | 162981044 | Click to see CC1(CCC2(C(C1)C3=CCC4C(C3(CC2O)C)(CCC5C4(CC(C(C5(C)CO)OC6C(C(C(C(O6)CO)O)OC7C(C(C(CO7)OC8C(C(C(C(O8)C(=O)O)O)O)O)O)OC9C(C(C(C(O9)CO)O)O)O)O)O)C)C)C(=O)O)CO | 1153.20 | unknown | https://doi.org/10.1080/14786410802625279 |
6-[6-[2-[[8a-Carboxy-2,8-dihydroxy-4,11-bis(hydroxymethyl)-4,6a,6b,11,14b-pentamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid | 162981043 | Click to see CC1(CCC2(C(C1)C3=CCC4C(C3(CC2O)C)(CCC5C4(CC(C(C5(C)CO)OC6C(C(C(C(O6)CO)O)OC7C(C(C(CO7)OC8C(C(C(C(O8)C(=O)O)O)O)O)O)OC9C(C(C(C(O9)CO)O)O)O)O)O)C)C)C(=O)O)CO | 1153.20 | unknown | https://doi.org/10.1080/14786410802625279 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Diterpene lactones | |||||
[(3R,4aS,6S,6aS,7R,10aR,10bR)-7-hydroxy-7-(hydroxymethyl)-4a,6a,10b-trimethyl-2'-oxospiro[1,2,5,6,8,9,10,10a-octahydrobenzo[f]chromene-3,4'-oxolane]-6-yl] (E)-3-phenylprop-2-enoate | 50908028 | Click to see CC12CCC3(CC(=O)OC3)OC1(CC(C4(C2CCCC4(CO)O)C)OC(=O)C=CC5=CC=CC=C5)C | 498.60 | unknown | via CMAUP database |
[(3S,4aS,6S,6aS,7R,10aR,10bR)-7-hydroxy-7-(hydroxymethyl)-4a,6a,10b-trimethyl-2'-oxospiro[1,2,5,6,8,9,10,10a-octahydrobenzo[f]chromene-3,4'-oxolane]-6-yl] (E)-3-phenylprop-2-enoate | 50908029 | Click to see CC12CCC3(CC(=O)OC3)OC1(CC(C4(C2CCCC4(CO)O)C)OC(=O)C=CC5=CC=CC=C5)C | 498.60 | unknown | via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cholestane steroids / Cholesterols and derivatives | |||||
(3S)-10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 6432564 | Click to see CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 386.70 | unknown | via CMAUP database |
Cholest-5-en-3-ol | 11025495 | Click to see CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 386.70 | unknown | via CMAUP database |
Cholesterol | 5997 | Click to see CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 386.70 | unknown | via CMAUP database |
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids | |||||
2-Azaniumylhexanoate | 517543 | Click to see CCCCC(C(=O)[O-])[NH3+] | 131.17 | unknown | via CMAUP database |
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters / Methyl esters | |||||
Methyl Acetate | 6584 | Click to see CC(=O)OC | 74.08 | unknown | via CMAUP database |
> Organic acids and derivatives / Organic phosphonic acids and derivatives / Phosphonic acid diesters / Dialkyl alkylphosphonates | |||||
1-Diethoxyphosphorylhexane | 85311 | Click to see CCCCCCP(=O)(OCC)OCC | 222.26 | unknown | via CMAUP database |
> Organic oxygen compounds / Organic oxides | |||||
beta-Cyclocitral | 9895 | Click to see CC1=C(C(CCC1)(C)C)C=O | 152.23 | unknown | via CMAUP database |
Safranal | 61041 | Click to see CC1=C(C(CC=C1)(C)C)C=O | 150.22 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds | |||||
beta-D-Fructofuranosyl alpha-D-glucopyranoside | 91692850 | 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 | via CMAUP database |
Sucrose | 5988 | 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 | via CMAUP database |
Sucrose NF | 46782954 | 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 | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides | |||||
(10R)-1-hydroxy-10-[(9R)-4-hydroxy-2-(hydroxymethyl)-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-3-(hydroxymethyl)-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-10H-anthracen-9-one | 101656035 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)CO)C=C(C=C4O)CO | 834.80 | unknown | https://doi.org/10.1111/J.2042-7158.1985.TB04946.X |
(10S)-1-hydroxy-10-[(9S)-4-hydroxy-2-(hydroxymethyl)-10-oxo-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-3-(hydroxymethyl)-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-10H-anthracen-9-one | 101656036 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)CO)C=C(C=C4O)CO | 834.80 | unknown |
https://doi.org/10.1111/J.2042-7158.1985.TB04946.X https://doi.org/10.1016/S0031-9422(00)89592-8 |
1-[1-Hydroxy-8-methoxy-3-methyl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxynaphthalen-2-yl]ethanone | 78178138 | Click to see CC1=CC2=CC(=CC(=C2C(=C1C(=O)C)O)OC)OC3C(C(C(C(O3)CO)O)O)O | 408.40 | unknown | https://doi.org/10.1055/S-2002-26738 |
1-hydroxy-10-[4-hydroxy-2-(hydroxymethyl)-10-oxo-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9H-anthracen-9-yl]-3-(hydroxymethyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-10H-anthracen-9-one | 78171407 | Click to see C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C6=C(C(=CC=C6)OC7C(C(C(C(O7)CO)O)O)O)C(=O)C8=C5C=C(C=C8O)CO)C=C(C=C4O)CO | 834.80 | unknown |
https://doi.org/10.1111/J.2042-7158.1985.TB04946.X https://doi.org/10.1016/S0031-9422(00)89592-8 |
3-hydroxy-5-(hydroxymethyl)-2-[2-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoyl]benzoic acid | 162986367 | Click to see C1=CC(=C(C(=C1)OC2C(C(C(C(O2)CO)O)O)O)C(=O)C3=C(C=C(C=C3O)CO)C(=O)O)O | 466.40 | unknown | https://doi.org/10.1055/S-2002-26738 |
3-Hydroxy-5-(hydroxymethyl)-2-[2-hydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoyl]benzoic acid | 162986366 | Click to see C1=CC(=C(C(=C1)OC2C(C(C(C(O2)CO)O)O)O)C(=O)C3=C(C=C(C=C3O)CO)C(=O)O)O | 466.40 | unknown | https://doi.org/10.1055/S-2002-26738 |
5-hydroxy-4-[2-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoyl]benzene-1,3-dicarboxylic acid | 162890386 | Click to see C1=CC(=C(C(=C1)OC2C(C(C(C(O2)CO)O)O)O)C(=O)C3=C(C=C(C=C3O)C(=O)O)C(=O)O)O | 480.40 | unknown | https://doi.org/10.1055/S-2002-26738 |
5-Hydroxy-4-[2-hydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoyl]benzene-1,3-dicarboxylic acid | 162890385 | Click to see C1=CC(=C(C(=C1)OC2C(C(C(C(O2)CO)O)O)O)C(=O)C3=C(C=C(C=C3O)C(=O)O)C(=O)O)O | 480.40 | unknown | https://doi.org/10.1055/S-2002-26738 |
Tinnevellin glucoside | 157631 | Click to see CC1=CC2=CC(=CC(=C2C(=C1C(=O)C)O)OC)OC3C(C(C(C(O3)CO)O)O)O | 408.40 | unknown | https://doi.org/10.1055/S-2002-26738 |
Torachrysone 8-glucoside | 14345578 | Click to see CC1=CC2=CC(=CC(=C2C(=C1C(=O)C)O)OC3C(C(C(C(O3)CO)O)O)O)OC | 408.40 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
Torachrysone 8-O-Glucoside | 11972479 | Click to see CC1=CC2=CC(=CC(=C2C(=C1C(=O)C)O)OC3C(C(C(C(O3)CO)O)O)O)OC | 408.40 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Hexoses | |||||
(2R,3S,4S,5R)-2,3,4,5,6-pentahydroxyhexanal | 3037556 | Click to see C(C(C(C(C(C=O)O)O)O)O)O | 180.16 | unknown | https://doi.org/10.1016/S0008-6215(01)00104-5 |
beta-D-glucose | 64689 | Click to see C(C1C(C(C(C(O1)O)O)O)O)O | 180.16 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Alpha-hydrogen aldehydes | |||||
Isovaleraldehyde | 11552 | Click to see CC(C)CC=O | 86.13 | unknown | via CMAUP database |
Valeraldehyde | 8063 | Click to see CCCCC=O | 86.13 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes | |||||
4-Heptenal | 5283318 | Click to see CCC=CCCC=O | 112.17 | unknown | via CMAUP database |
cis-4-Heptenal | 5362814 | Click to see CCC=CCCC=O | 112.17 | unknown | via CMAUP database |
Heptanal | 8130 | Click to see CCCCCCC=O | 114.19 | unknown | via CMAUP database |
Hexanal | 6184 | Click to see CCCCCC=O | 100.16 | unknown | via CMAUP database |
Nonanal | 31289 | Click to see CCCCCCCCC=O | 142.24 | unknown | via CMAUP database |
Octanal | 454 | Click to see CCCCCCCC=O | 128.21 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Alpha-branched alpha,beta-unsaturated ketones | |||||
3-Methyl-3-buten-2-one | 13143 | Click to see CC(=C)C(=O)C | 84.12 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Enones | |||||
(E,E)-3,5-octadien-2-one | 5352876 | Click to see CCC=CC=CC(=O)C | 124.18 | unknown | via CMAUP database |
3,5-Octadien-2-one | 181575 | Click to see CCC=CC=CC(=O)C | 124.18 | unknown | via CMAUP database |
6-Methyl-3,5-heptadien-2-one | 5370101 | Click to see CC(=CC=CC(=O)C)C | 124.18 | unknown | via CMAUP database |
6,10-Dimethylundecadien-2-one | 14619638 | Click to see CC(C)CCCC(=CC=CC(=O)C)C | 194.31 | unknown | via CMAUP database |
Damascenone | 5366074 | Click to see CC=CC(=O)C1=C(C=CCC1(C)C)C | 190.28 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones | |||||
(R)-2,2,6-Trimethylcyclohexanone | 6999893 | Click to see CC1CCCC(C1=O)(C)C | 140.22 | unknown | via CMAUP database |
(S)-2,2,6-Trimethylcyclohexanone | 6992946 | Click to see CC1CCCC(C1=O)(C)C | 140.22 | unknown | via CMAUP database |
2,2,6-Trimethylcyclohexanone | 17000 | Click to see CC1CCCC(C1=O)(C)C | 140.22 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones | |||||
2-Heptanone | 8051 | Click to see CCCCCC(=O)C | 114.19 | unknown | via CMAUP database |
2-Octanone | 8093 | Click to see CCCCCCC(=O)C | 128.21 | unknown | via CMAUP database |
6-Methyl-5-hepten-2-one | 9862 | Click to see CC(=CCCC(=O)C)C | 126.20 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones / Alpha-diketones | |||||
2,3-Octanedione | 11449 | Click to see CCCCCC(=O)C(=O)C | 142.20 | unknown | via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones | |||||
Propiophenone | 7148 | Click to see CCC(=O)C1=CC=CC=C1 | 134.17 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Benzofurans | |||||
4,4,7a-Trimethyl-5,6,7,7a-tetrahydrobenzofuran-2(4H)-one | 27209 | Click to see CC1(CCCC2(C1=CC(=O)O2)C)C | 180.24 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Heteroaromatic compounds | |||||
2-Ethylfuran | 18554 | Click to see CCC1=CC=CO1 | 96.13 | unknown | via CMAUP database |
2-Methylfuran | 10797 | Click to see CC1=CC=CO1 | 82.10 | unknown | via CMAUP database |
2-Pentylfuran | 19602 | Click to see CCCCCC1=CC=CO1 | 138.21 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Indoles and derivatives / Tryptamines and derivatives | |||||
N,N-Dimethyl-5-methoxytryptamine | 1832 | Click to see CN(C)CCC1=CNC2=C1C=C(C=C2)OC | 218.29 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones | |||||
2(3H)-Furanone, dihydro-5,5-dimethyl-4-(3-oxobutyl)- | 138243 | Click to see CC(=O)CCC1CC(=O)OC1(C)C | 184.23 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Naphthopyrans | |||||
CID 50908026 | 50908026 | Click to see CC12CCC3(CC(=O)OC3)OC1(CC(C4(C2CCCC45CO5)C)OC(=O)C=CC6=CC=CC=C6)C | 480.60 | unknown | via CMAUP database |
CID 50908027 | 50908027 | Click to see CC12CCC3(CC(=O)OC3)OC1(CC(C4(C2CCCC45CO5)C)OC(=O)C=CC6=CC=CC=C6)C | 480.60 | unknown | via CMAUP database |
Karwinaphthol B | 442522 | Click to see CC1CC2=CC3=CC(=CC(=C3C(=C2C(O1)C)O)OC)OC | 288.34 | unknown | via CMAUP database |
> Organoheterocyclic compounds / Oxanes | |||||
Eucalyptol | 2758 | Click to see CC1(C2CCC(O1)(CC2)C)C | 154.25 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Cinnamic acid esters | |||||
[(1S,3S,4R,4aR,8R,8aS)-3-hydroxy-3,4,8a-trimethyl-4-[2-(5-oxo-2H-furan-3-yl)ethyl]spiro[1,2,4a,5,6,7-hexahydronaphthalene-8,2'-oxirane]-1-yl] (E)-3-phenylprop-2-enoate | 50908025 | Click to see CC1(CC(C2(C(C1(C)CCC3=CC(=O)OC3)CCCC24CO4)C)OC(=O)C=CC5=CC=CC=C5)O | 480.60 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Diarylheptanoids / Linear diarylheptanoids | |||||
Tocris-1610 | 6603986 | Click to see CC1=C(C(=C(C(=C1O)C(=O)C)O)CC2=C(C(=C3C(=C2O)C=CC(O3)(C)C)C(=O)C=CC4=CC=CC=C4)O)O | 516.50 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavones | |||||
Kaempferol oxoanion | 25202062 | Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)[O-])O | 285.23 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols | |||||
Isorhamnetin | 5281654 | Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O | 316.26 | unknown |
https://doi.org/10.1002/ARDP.19002380604 https://doi.org/10.1039/CT9130302006 |
Kaempferol | 5280863 | Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O | 286.24 | unknown |
https://doi.org/10.1039/CT9130302006 https://doi.org/10.1055/S-2002-26738 |
Quercetin | 5280343 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O | 302.23 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides / Flavonoid 8-C-glycosides | |||||
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 | https://doi.org/10.1055/S-2002-26738 |
Vicenin-2 | 3084407 | 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 | https://doi.org/10.1055/S-2002-26738 |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides | |||||
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one | 13915963 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O)O)O | 626.50 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
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/10.1021/JA01160A019 |
Astragaloside | 5488387 | Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O)O | 640.50 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
Isorhamnetin 3-gentiobioside | 44259334 | Click to see COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O)O | 640.50 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
Kaempferol 3-gentiobioside | 9960512 | Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O)O | 610.50 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
kaempferol-3-O-hexoxyl-hexoside | 14228859 | Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O)O | 610.50 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
Quercetin 3-gentiobioside | 5320834 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O)O)O | 626.50 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
Quercetin-3-gentiobioside | 13915961 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O)O)O | 626.50 | unknown | https://doi.org/10.1016/S0031-9422(00)89592-8 |
> Phenylpropanoids and polyketides / Isochromanequinones / Benzoisochromanequinones | |||||
(1R)-3,4-Dihydro-7,9-dimethoxy-6-hydroxy-1beta,3beta-dimethyl-1H-naphtho[2,3-c]pyran-5,10-dione | 101418259 | Click to see CC1CC2=C(C(O1)C)C(=O)C3=C(C2=O)C(=C(C=C3OC)OC)O | 318.32 | unknown | via CMAUP database |
(S)-3beta-Methyl-7,9-dimethoxy-3,4,5,10-tetrahydro-1H-naphtho[2,3-c]pyran-5,10-dione | 45257195 | Click to see CC1CC2=C(CO1)C(=O)C3=C(C2=O)C=C(C=C3OC)OC | 288.29 | unknown | via CMAUP database |
7-Methoxyeleutherin | 11822781 | Click to see CC1CC2=C(C(O1)C)C(=O)C3=C(C2=O)C=C(C=C3OC)OC | 302.32 | unknown | via CMAUP database |
> Phenylpropanoids and polyketides / Isoflavonoids / Coumestans | |||||
1,3-Dihydroxy-8,9-dimethoxy-[1]benzofuro[3,2-c]chromen-6-one | 11602329 | Click to see COC1=C(C=C2C(=C1)C3=C(O2)C4=C(C=C(C=C4OC3=O)O)O)OC | 328.27 | unknown |
https://doi.org/10.1016/0021-9673(96)00141-0 https://doi.org/10.1002/ARDP.19002380604 |
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