Perilla frutescens
Details Top
| Internal ID | UUID643fe6ad7118b092375839 |
| Scientific name | Perilla frutescens |
| Authority | (L.) Britton |
| First published in | Mem. Torrey Bot. Club 5: 277 (1894) |
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.
Perilla frutescens, commonly known as perilla or shiso, has a long history of use in East Asian traditional medicine. In Korea, the dried leaves are steeped in hot water to make a mild tea that is prescribed for cough, asthma, and allergic rhinitis; this practice is documented in Kim et al., 2015. Chinese herbalists have used a decoction of the fresh leaves and stems to treat bronchitis and to relieve nasal congestion, as reported by Li et al., 2018. In Japan, Kampo preparations of perilla leaf decoction are employed for colds, sore throats, and digestive upset, a use noted by Sato et al., 2016. The plant is also used by the Hmong of Laos, who brew a decoction of the leaves to alleviate fever and flu symptoms, according to Nguyen et al., 2019. In each of these cultures, the infusion is typically made from the fresh or dried aerial parts, sometimes combined with other herbs, and consumed orally.
A simple, safe recipe for a perilla leaf tea is as follows: take 5 g of dried perilla leaves, place them in a teapot, pour 200 ml of boiling water, cover, and steep for 5 minutes. Strain the liquid and drink warm. This preparation yields a mild, slightly minty flavor that is pleasant for most people. The tea is generally considered safe for adults, but pregnant or breastfeeding women should consult a healthcare provider before use, as perilla contains compounds that may have estrogenic activity. Avoid exceeding 10 g of leaves per day to stay within traditional dosage limits.
The therapeutic effects of perilla are largely attributed to its well‑characterized phytochemicals. The leaves are rich in rosmarinic acid, a potent antioxidant and anti‑inflammatory agent, and perillaldehyde, which has been shown to possess bronchodilatory properties. Flavonoids such as luteolin and quercetin contribute to the plant’s anti‑viral and anti‑allergic activities. These constituents have been isolated and quantified in multiple phytochemical studies, providing a clear biochemical basis for the plant’s traditional uses in respiratory and allergic conditions.
Modern research continues to explore perilla’s potential. Recent in‑vitro studies have demonstrated that perilla extracts can inhibit influenza virus replication, and animal models suggest anti‑asthmatic effects that mirror the traditional Korean decoction. Commercially, perilla leaf tea is available in specialty health food stores and online, and the plant’s essential oil is marketed for aromatherapy and culinary purposes. The enduring use of perilla in traditional medicine, coupled with emerging scientific evidence, underscores its relevance as a natural remedy for respiratory ailments.
General Uses Top
Suggest a correction!Common products
- Perilla frutescens seed oil, extracted from the seeds, is used as a cooking oil and as a base for sauces and dressings.
- Perilla leaf, harvested fresh or pickled, is used as a culinary herb in Korean kimchi, Japanese shiso, and other East Asian dishes.
- Perilla essential oil, obtained from leaves and seeds, is used as a flavoring and fragrance ingredient in food products and cosmetics.
Industrial and craft applications
- Seed oil is processed into biodiesel due to its high unsaturation (α‑linolenic acid content > 50 %).
- Essential oil is incorporated into flavoring blends for confectionery, beverages, and savory sauces.
- The oil’s high iodine value (≈ 120 g I₂/100 g) makes it suitable for use in industrial lubricants and as a raw material for polymer additives.
Food and beverages (non‑medicinal)
- Leaves are a key ingredient in Korean kimchi, Japanese shiso salads, and Korean pancakes (jeon).
- Seed oil is used for stir‑frying, as a finishing oil, and in salad dressings.
- The oil is also used in traditional Korean sauces such as doenjang and gochujang for flavor enhancement.
Fragrance and cosmetics
- Perilla essential oil, rich in perillaldehyde, is used as a fragrance component in soaps, lotions, and perfumery.
- The oil’s mild, herbaceous aroma is blended with other botanical extracts in cosmetic formulations.
Properties relevant to use
- Seed oil: high unsaturated fatty acid ratio (α‑linolenic acid > 50 %), low saponification value (~190 mg KOH/g), high iodine value (~120 g I₂/100 g).
- Essential oil: dominant compound perillaldehyde (≈ 70 % of total oil), with minor constituents such as perillene and rosmarinic acid.
- Leaves: contain essential oils (~0.5 % of fresh weight) and rosmarinic acid, contributing to flavor profile.
Standards and regulation
- In Korea, perilla seed oil is listed as a food ingredient under the Korean Food Code and is subject to HACCP certification.
- In Japan, the oil is regulated under the Food Sanitation Act and must meet the Japanese Food Standards Agency (JFSA) specifications for edible oils.
- Perilla essential oil used in cosmetics is registered under the EU Cosmetics Regulation (EC) No 1223/2009 and must comply with the Cosmetic Ingredient Database (CosIng) requirements.
Sustainability and sourcing
- Perilla frutescens is cultivated in temperate regions of East Asia, with low input requirements for fertilizer and pesticides.
- The plant can be harvested multiple times per season, providing both leaf and seed yields, which enhances land‑use efficiency.
- Seed oil production for biodiesel reduces reliance on fossil fuels and can be integrated into small‑scale, organic farming systems.
- Intercropping with legumes and other cover crops is common, improving soil health and reducing erosion.
Synonyms Top
| Scientific name | Authority | First published in |
|---|---|---|
| Ocimum frutescens | L. | Sp. Pl. : 597 (1753) |
| Perilla frutescens var. laviniata | W.Mill. & L.H.Bailey | Stand. Cycl. Hort. 5: 2553. 1916 |
| Perilla ocymoides | L. | Gen. Pl. ed. 6 : 578 (1764) |
| Perilla ocymoides var. japonica | Hassk. | Retzia 2: 36. 1856 |
| Perilla ocymoides var. purpurascens | Hayata | Icon. Pl. Formosan. 8: 103 1919 |
| Perilla urticifolia | Salisb. | Prodr. Stirp. Chap. Allerton : 80 (1796) |
| Perilla ocymoides f. discolor | Makino | Bot. Mag. (Tokyo) 26: 78 1912 |
| Perilla ocymoides f. purpurea | Makino | Bot. Mag. (Tokyo) 26: 78 1912 |
| Perilla ocymoides f. viridis | Makino | Bot. Mag. (Tokyo) 26: 78 1912 |
| Perilla ocymoides f. viridicrispa | Makino | Bot. Mag. (Tokyo) 28: 180 1914 |
| Perilla frutescens var. typica | Makino | J. Jap. Bot. 3: 7 (1926) |
Common names Top
Add a new one! Suggest a correction!| Language | Common/alternative name |
|---|---|
| English | korean perilla |
| English | deulkkae |
| Arabic | بريلة |
| Azerbaijani | kolşəkilli perilla |
| Czech | perila křovitá |
| Esperanto | duonligna periljo |
| Persian | شیسو |
| Finnish | veripeippi |
| Croatian | crna kopriva |
| Japanese | 荏胡麻 |
| Japanese | 荏 |
| Japanese | エゴマ |
| Korean | 들깨 |
| la | melissa maxima |
| la | mentha perilloides |
| lzh | 白蘇 |
| lzh | 水荏 |
| lzh | 荏子 |
| lzh | 野荏 |
| mnc | ᠰᠠᡥᠠᠯᡳᠶᠠᠨ ᠮᠠᠯᠠᠩᡤᡡ |
| Nepali | सिलाम |
| Polish | pachnotka krzewiasta |
| Polish | pachnotka zwyczajna |
| Polish | pachnotka bazyliowata |
| Russian | Перилла кустарниковидная |
| Slovenian | perila |
| Slovenian | črna kopriva |
| Slovenian | dšiso |
| Swedish | shiso |
| Swedish | bladmynta |
| Chinese | 紫蘇 |
| Chinese | 蘇葉 |
| Chinese | 蘇子葉 |
| Chinese | 蘇子 |
| Chinese | 白紫蘇 |
| Chinese | 苏子叶 |
| Chinese | 苏子 |
| Chinese | 苏叶 |
| Chinese | 白蘇 |
| Chinese | 紫苏叶 |
| Chinese | 紫苏(白苏) |
| Chinese | 紫苏(白苏) |
| Chinese | 白苏梗 |
| Chinese | 白苏子油 |
| Chinese | 白苏子 |
| Chinese | 白苏叶 |
| Chinese | 白苏 |
| Chinese | 苏头 |
| Chinese | 紫苏梗 |
| Chinese | 紫苏子 |
| Chinese | 兴帕夏噶 |
| Chinese | 紫苏 |
| Chinese | 荏 |
| Chinese | 桂荏 |
| Chinese | 假紫苏 |
| Chinese | 鸡苏 |
| Chinese | 苏 |
| Chinese | 野苏麻 |
| Chinese | 野生紫苏 |
| Chinese | 薄荷 |
| Chinese | 红勾苏 |
| Chinese | 黑苏 |
| Chinese | 香苏 |
| Chinese | 青苏 |
| Chinese | 野藿麻 |
| Chinese | 野紫苏子 |
| Chinese | 赤苏 |
| Chinese | 荏子 |
| Chinese | 臭苏 |
| Chinese | 聋耳麻 |
| Chinese | 香荽 |
| Chinese | 白紫苏 |
| Chinese | 江苏 |
| Chinese | 水升麻 |
| Chinese | 梗为紫苏梗 |
| Chinese | 孜珠 |
| Chinese | 子为紫苏子 |
| Chinese | 头为紫苏头蔸 |
| Chinese | 大紫苏 |
| Chinese | 叶为紫苏叶 |
Varieties (abbr. var.) Top
Add a new one! Suggest a correction!| Name | Authority | First published in |
|---|---|---|
| Perilla frutescens var. crispa | W.Deane | Rhodora 25: 40 (1923) |
| Perilla frutescens var. frutescens | Unknown | |
| Perilla frutescens var. hirtella | (Nakai) Makino | Fl. Japan , ed. 2: 218 (1931) |
Germination/Propagation Top
Suggest a correction or add new data!| Sow seeds at 20°C, expecting germination within 3 months without further temperature treatment. |
| Requires Light or Surface Sowing: These seeds need light to germinate and should not be covered with soil or only very lightly. They are often very small and sown directly on the surface of the growing medium. |
Distribution (via POWO/KEW) Top
Legend for the distribution data:
- Doubtful data
- Extinct
- Introduced
- Native
-
Asia-temperate click to expand
-
Caucasus
- Transcaucasus
-
China
- China South-central
- China Southeast
-
Eastern Asia
- Japan
- Korea
- Taiwan
-
Russian Far East
- Khabarovsk
- Primorye
-
Caucasus
-
Asia-tropical click to expand
-
Indian Subcontinent
- Assam
- Bangladesh
- East Himalaya
- India
- Nepal
- West Himalaya
-
Indo-China
- Cambodia
- Laos
- Myanmar
- Thailand
- Vietnam
-
Malesia
- Jawa
-
Indian Subcontinent
-
Europe click to expand
-
Eastern Europe
- South European Russia
- Ukraine
-
Southeastern Europe
- Romania
-
Eastern Europe
-
Northern America click to expand
-
Eastern Canada
- Ontario
-
North-central U.S.A.
- Illinois
- Iowa
- Kansas
- Minnesota
- Missouri
- Nebraska
- Oklahoma
- Wisconsin
-
Northeastern U.S.A.
- Connecticut
- Indiana
- Massachusetts
- Michigan
- New Jersey
- New York
- Ohio
- Pennsylvania
- West Virginia
-
South-central U.S.A.
- Texas
-
Southeastern U.S.A.
- Alabama
- Arkansas
- Delaware
- District Of Columbia
- Florida
- Georgia
- Kentucky
- Louisiana
- Maryland
- Mississippi
- North Carolina
- South Carolina
- Tennessee
- Virginia
-
Eastern Canada
Links to other databases Top
Suggest others/fix!| Database | ID/link to page |
|---|---|
| World Flora Online | wfo-0000267281 |
| UNII | XUR646842C |
| Florida Plant Atlas | 1658 |
| Flora of Alabama | 2435 |
| Canadensys | 6430 |
| USDA Plants | PEFR4 |
| Tropicos | 17601586 |
| INPN | 610862 |
| Flora of Italy | 4658 |
| KEW | urn:lsid:ipni.org:names:190343-2 |
| The Plant List | kew-150299 |
| Missouri Botanical Garden | 281498 |
| Open Tree Of Life | 295678 |
| Observations.org | 125823 |
| NCBI Taxonomy | 151328 |
| NBN Atlas | NBNSYS0200002825 |
| Nature Serve | 2.151611 |
| IUCN Red List | 149445472 |
| IPNI | 190343-2 |
| iNaturalist | 119136 |
| GBIF | 5341394 |
| WisFlora | 8387 |
| EPPO | PRJFR |
| EOL | 579366 |
| USDA GRIN | 27364 |
| Wikipedia | Perilla_frutescens |
| CMAUP | NPO8650 |
| Open Tree Of Life | 594591 |
| Plantarium | 27345 |
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 |
|---|---|---|---|---|---|
| > Benzenoids / Benzene and substituted derivatives | |||||
| (S)-Mandelonitrile | 439767 | Click to see C1=CC=C(C=C1)C(C#N)O | 133.15 | unknown | via CMAUP database |
| Benzaldehyde, oxime, (Z)- | 5324470 | Click to see C1=CC=C(C=C1)C=NO | 121.14 | unknown | via CMAUP database |
| Mandelonitrile, (+)- | 9548674 | Click to see | 133.15 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters | |||||
| Methyl Benzoate | 7150 | Click to see | 136.15 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acids | |||||
| (~2~H_4_)Benzene-1,2-dicarboxylic acid | 16212019 | Click to see | 170.15 | unknown | via CMAUP database |
| Phthalic Acid | 1017 | Click to see | 166.13 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives | |||||
| 4-Hydroxybenzoic acid | 135 | Click to see C1=CC(=CC=C1C(=O)O)O | 138.12 | unknown | via CMAUP database |
| Protocatechuic Acid | 72 | Click to see | 154.12 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Gallic acids | |||||
| Gallic Acid | 370 | Click to see | 170.12 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives | |||||
| Vanillic Acid | 8468 | Click to see COC1=C(C=CC(=C1)C(=O)O)O | 168.15 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / P-methoxybenzoic acids and derivatives | |||||
| Isovanillic Acid | 12575 | Click to see | 168.15 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / p-Hydroxybenzoic acid esters / p-Hydroxybenzoic acid alkyl esters | |||||
| Protocatechuic acid, methyl ester | 287064 | Click to see COC(=O)C1=CC(=C(C=C1)O)O | 168.15 | unknown | https://doi.org/10.1271/BBB.60.1093 |
| > Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives | |||||
| Benzaldehyde | 240 | Click to see | 106.12 | unknown |
https://doi.org/10.1021/JF00023A054 https://doi.org/10.1080/10412905.1995.9698555 https://doi.org/10.1016/0031-9422(83)83016-7 |
| > Benzenoids / Benzene and substituted derivatives / Cumenes | |||||
| m-Cymene | 10812 | Click to see CC1=CC(=CC=C1)C(C)C | 134.22 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Phenylacetaldehydes | |||||
| Phenylacetaldehyde | 998 | Click to see C1=CC=C(C=C1)CC=O | 120.15 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Phenylpropanes | |||||
| 4-[(2~{R})-butan-2-yl]phenol | 38989049 | Click to see | 150.22 | unknown | via CMAUP database |
| > Benzenoids / Naphthalenes / Naphthalenecarboxylic acids and derivatives / Naphthalenecarboxylic acids | |||||
| Fisheacid | 139583718 | Click to see C1C(C(=CC2=CC=CC=C21)C3=CC4=CC=CC=C4CC3C(=O)O)C(=O)O | 346.40 | unknown | https://doi.org/10.1271/BBB1961.54.1745 |
| > Benzenoids / Phenol ethers / Anisoles | |||||
| Anisole | 7519 | Click to see COC1=CC=CC=C1 | 108.14 | unknown | via CMAUP database |
| Asarone | 636822 | Click to see | 208.25 | unknown | via CMAUP database |
| Beta-Asarone | 5281758 | Click to see | 208.25 | unknown | via CMAUP database |
| Elemicin | 10248 | Click to see | 208.25 | unknown |
https://doi.org/10.1055/S-2006-961996 https://doi.org/10.1016/0031-9422(86)80017-6 https://doi.org/10.1016/0031-9422(86)80070-X |
| Estragole | 8815 | Click to see | 148.20 | unknown | https://doi.org/10.1080/10412905.2007.9699213 |
| > Benzenoids / Phenols / Benzenediols / Catechols | |||||
| (2R)-3-(3,4-dihydroxyphenyl)-2-hydroxypropanamide | 130619547 | Click to see | 197.19 | unknown | https://doi.org/10.1248/CPB.43.887 |
| (5S)-5-[(3,4-dihydroxyphenyl)methyl]-1,3-oxazolidine-2,4-dione | 163025275 | Click to see | 223.18 | unknown | https://doi.org/10.1248/CPB.43.887 |
| 3-(3,4-Dihydroxyphenyl)lactamide | 10035593 | Click to see | 197.19 | unknown | https://doi.org/10.1248/CPB.43.887 |
| 5-[(3,4-Dihydroxyphenyl)methyl]-1,3-oxazolidine-2,4-dione | 10013832 | Click to see | 223.18 | unknown | https://doi.org/10.1248/CPB.43.887 |
| > Benzenoids / Phenols / Methoxyphenols | |||||
| 2-Methoxy-3-(2-propenyl)phenol | 596373 | Click to see | 164.20 | unknown | via CMAUP database |
| Eugenol | 3314 | Click to see | 164.20 | unknown | https://doi.org/10.1016/0031-9422(83)83016-7 |
| Isoeugenol | 853433 | Click to see | 164.20 | unknown | https://doi.org/10.1021/JF00023A054 |
| Propenylguaiacol | 7338 | Click to see | 164.20 | unknown | https://doi.org/10.1021/JF00023A054 |
| > Hydrocarbons / Saturated hydrocarbons / Alkanes | |||||
| Dodecane | 8182 | Click to see | 170.33 | unknown | via CMAUP database |
| n-HEXANE | 8058 | Click to see CCCCCC | 86.18 | unknown | via CMAUP database |
| > Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons | |||||
| (Z,Z,Z)-1,5,9,9-Tetramethyl-1,4,7-cycloundecatriene | 5368784 | Click to see | 204.35 | unknown | via CMAUP database |
| Ocimene | 6434062 | Click to see | 136.23 | unknown | https://doi.org/10.1021/JF00023A054 |
| > Lignans, neolignans and related compounds / Cyclobutane lignans | |||||
| 1-[(1R,2R)-2,3-dimethyl-4-(2,4,5-trimethoxyphenyl)cyclobutyl]-2,4,5-trimethoxybenzene | 5318447 | Click to see | 416.50 | unknown | https://doi.org/10.1016/S0960-894X(01)00812-5 |
| 1-[(1R,2S,3S,4R)-2,3-dimethyl-4-(2,4,5-trimethoxyphenyl)cyclobutyl]-2,4,5-trimethoxybenzene | 10341859 | Click to see | 416.50 | unknown | https://doi.org/10.1016/S0960-894X(01)00812-5 |
| Heterotropan | 126324 | Click to see | 416.50 | unknown | https://doi.org/10.1016/S0960-894X(01)00812-5 |
| Magnosalin | 10454589 | Click to see | 416.50 | unknown | https://doi.org/10.1016/S0960-894X(01)00812-5 |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids | |||||
| cis-11-Eicosenoic acid | 5282768 | Click to see | 310.50 | unknown | via CMAUP database |
| Dihomo-Gamma-Linolenic Acid | 5280581 | Click to see | 306.50 | unknown | via CMAUP database |
| Eicosanoic Acid | 10467 | Click to see | 312.50 | unknown | via CMAUP database |
| Elaidic Acid | 637517 | Click to see CCCCCCCCC=CCCCCCCCC(=O)O | 282.50 | unknown | via CMAUP database |
| Octadecanoate | 3033836 | Click to see | 283.50 | unknown | via CMAUP database |
| Oleic Acid | 445639 | Click to see | 282.50 | unknown | via CMAUP database |
| Oleic acid-d2 | 13011408 | Click to see CCCCCCCCC=CCCCCCCCC(=O)O | 284.50 | unknown | via CMAUP database |
| Palmitic Acid | 985 | Click to see | 256.42 | unknown | via CMAUP database |
| Stearic Acid | 5281 | Click to see | 284.50 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids | |||||
| (3E,9E)-undeca-3,9-dienoic acid | 52914864 | Click to see CC=CCCCCC=CCC(=O)O | 182.26 | unknown | via CMAUP database |
| Npc283274 | 11252659 | Click to see | 201.32 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides | |||||
| (3R)-3,7-Dimethylocta-1,6-dien-3-yl beta-D-glucopyranoside | 38358979 | Click to see | 316.39 | unknown | via CMAUP database |
| (3R)-5-phenyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentanoic acid | 11792570 | Click to see | 356.40 | unknown | https://doi.org/10.1271/BBB.60.732 |
| 2-(3,7-Dimethylocta-1,6-dien-3-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol | 14190656 | Click to see | 316.39 | unknown | https://doi.org/10.1016/0031-9422(94)85096-8 |
| 2-[2-Pent-2-enyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopentyl]acetic acid | 74817087 | Click to see | 374.40 | unknown | https://doi.org/10.1271/BBB.60.732 |
| 2-[3-Oxo-2-[5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypent-2-enyl]cyclopentyl]acetic acid | 4480898 | Click to see | 388.40 | unknown | https://doi.org/10.1271/BBB.60.732 |
| Cyclopentaneacetic acid, 3-(I(2)-D-glucopyranosyloxy)-2-(2-pentenyl)-, [1R-[1I+/-,2I(2)(Z),3I+/-]]- | 163086025 | Click to see | 374.40 | unknown | https://doi.org/10.1271/BBB.60.732 |
| D-Linalool 3-glucoside | 10087123 | Click to see CC(=CCCC(C)(C=C)OC1C(C(C(C(O1)CO)O)O)O)C | 316.39 | unknown | https://doi.org/10.1016/0031-9422(94)85096-8 |
| Tuberonic acid glucoside | 5281204 | Click to see | 388.40 | unknown | https://doi.org/10.1271/BBB.60.732 |
| xi-3-Hydroxy-5-phenylpentanoic acid O-beta-D-Glucopyranoside | 16681750 | Click to see C1=CC=C(C=C1)CCC(CC(=O)O)OC2C(C(C(C(O2)CO)O)O)O | 356.40 | unknown | https://doi.org/10.1271/BBB.60.732 |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols | |||||
| (+)-3-Octanol | 6999002 | Click to see | 130.23 | unknown | via CMAUP database |
| (R)-oct-1-en-3-ol | 6992244 | Click to see | 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-Octen-3-Ol | 18827 | Click to see | 128.21 | unknown | https://doi.org/10.1016/0031-9422(83)83016-7 |
| 10-Undecyn-1-ol | 76015 | Click to see C#CCCCCCCCCCO | 168.28 | unknown | via CMAUP database |
| 2-Hexen-1-OL | 5318042 | Click to see CCCC=CCO | 100.16 | unknown | via CMAUP database |
| 3-Hexen-1-ol | 10993 | Click to see | 100.16 | unknown | https://doi.org/10.1016/0031-9422(83)83016-7 |
| 3-Octanol | 11527 | Click to see CCCCCC(CC)O | 130.23 | unknown |
https://doi.org/10.1080/10412905.1995.9698555 https://doi.org/10.1016/0031-9422(83)83016-7 |
| cis-2-Hexen-1-ol | 5324489 | Click to see CCCC=CCO | 100.16 | unknown | via CMAUP database |
| cis-3-Hexen-1-ol | 5281167 | Click to see CCC=CCCO | 100.16 | unknown | via CMAUP database |
| Octan-3R-ol | 445789 | Click to see | 130.23 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives | |||||
| Elaidolinolenic acid | 5282822 | Click to see | 278.40 | unknown | https://doi.org/10.1007/BF02662172 |
| Linoleic Acid | 5280450 | Click to see CCCCCC=CCC=CCCCCCCCC(=O)O | 280.40 | unknown | https://doi.org/10.1007/BF02662172 |
| Linolenic Acid | 5280934 | Click to see | 278.40 | unknown | https://doi.org/10.1007/BF02662172 |
| > Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives / Jasmonic acids | |||||
| (+)-Tuberonic acid | 6443968 | Click to see | 226.27 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Glycerolipids / Monoradylglycerols / Monoacylglycerols / 1-monoacylglycerols | |||||
| 1-Monopalmitin | 14900 | Click to see | 330.50 | unknown | https://doi.org/10.1271/BBB.58.2241 |
| Glyceryl monooleate | 5283468 | Click to see CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)O | 356.50 | unknown | https://doi.org/10.1271/BBB.58.2241 |
| > Lipids and lipid-like molecules / Glycerolipids / Triradylcglycerols / Triacylglycerols | |||||
| Trilinolein | 5322095 | Click to see CCCCCC=CCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCC=CCCCCC)OC(=O)CCCCCCCC=CCC=CCCCCC | 879.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Acyclic diterpenoids | |||||
| (E,7R,11R)-15-methyl-3,7,11-tri((113C)methyl)(1,5,9,13,16-13C5)hexadec-2-en-1-ol | 11301173 | Click to see | 304.47 | 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 | via CMAUP database |
| 3,7,11,15-Tetramethylhexadec-2-en-1-ol | 145386 | Click to see | 296.50 | 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 |
| Npc117493 | 9018 | Click to see | 296.50 | unknown | via CMAUP database |
| Phytol | 5280435 | 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 / Isoprenoid phosphates | |||||
| Geranyl Diphosphate | 445995 | Click to see | 314.21 | unknown | https://doi.org/10.1016/0031-9422(86)80017-6 |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids | |||||
| 3,7-Dimethylocta-2,6-Dienal | 8843 | Click to see | 152.23 | unknown | https://doi.org/10.1016/0031-9422(90)87094-B |
| beta-OCIMENE, (3E)- | 5281553 | Click to see | 136.23 | unknown | https://doi.org/10.1021/JF00023A054 |
| beta-Ocimene, (3Z)- | 5320250 | Click to see | 136.23 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| Citral | 638011 | Click to see | 152.23 | unknown |
https://doi.org/10.1016/0031-9422(90)87094-B https://doi.org/10.1007/BF00554619 |
| Geraniol | 637566 | Click to see CC(=CCCC(=CCO)C)C | 154.25 | unknown | https://doi.org/10.1016/0031-9422(91)83022-D |
| Geranonitrile | 1551246 | Click to see | 149.23 | unknown | via CMAUP database |
| Linalool | 6549 | Click to see | 154.25 | unknown |
https://doi.org/10.1080/10412905.1995.9698555 https://doi.org/10.1016/0031-9422(83)83016-7 https://doi.org/10.1021/JF00023A054 |
| Linalool, (-)- | 443158 | Click to see CC(=CCCC(C)(C=C)O)C | 154.25 | unknown | via CMAUP database |
| Linalool, (+)- | 67179 | Click to see | 154.25 | unknown | via CMAUP database |
| Methyl geranate | 5365910 | Click to see | 182.26 | unknown | via CMAUP database |
| Methyl-3,7-dimethyl-2,6-octadienoate | 70917 | Click to see CC(=CCCC(=CC(=O)OC)C)C | 182.26 | unknown | via CMAUP database |
| Methylgeranate | 22565016 | Click to see | 181.25 | unknown | via CMAUP database |
| Myrcene | 31253 | Click to see | 136.23 | unknown |
https://doi.org/10.1080/10412905.1995.9698555 https://doi.org/10.1021/JF00023A054 |
| Neral | 643779 | Click to see | 152.23 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids | |||||
| 4-Isopropylbenzoic acid | 10820 | Click to see CC(C)C1=CC=C(C=C1)C(=O)O | 164.20 | unknown | via CMAUP database |
| 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 | 134.22 | unknown |
https://doi.org/10.1016/0031-9422(83)83016-7 https://doi.org/10.1080/10412905.1995.9698555 |
| Thymol | 6989 | Click to see | 150.22 | unknown | via CMAUP database |
| Thymyl methyl ether | 14104 | Click to see | 164.24 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids | |||||
| (-)-alpha-Pinene | 440968 | Click to see CC1=CCC2CC1C2(C)C | 136.23 | unknown | via CMAUP database |
| (-)-Camphene | 440966 | Click to see | 136.23 | unknown | via CMAUP database |
| (+-)-alpha-Pinene | 6654 | Click to see | 136.23 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| (+)-Bornyl acetate | 6950274 | Click to see CC(=O)OC1CC2CCC1(C2(C)C)C | 196.29 | unknown | via CMAUP database |
| (1R,2S,4R)-(+)-Bornyl acetate | 443131 | Click to see | 196.29 | unknown | via CMAUP database |
| (1S,2R,4S)-(-)-Bornyl acetate | 442460 | Click to see | 196.29 | unknown | via CMAUP database |
| Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester | 6448 | Click to see | 196.29 | unknown | via CMAUP database |
| alpha-Bergamotene | 86608 | Click to see | 204.35 | unknown | https://doi.org/10.1021/JF00023A054 |
| alpha-CIS-BERGAMOTENE | 6429303 | Click to see CC1=CCC2CC1C2(C)CCC=C(C)C | 204.35 | unknown | via CMAUP database |
| Beta-Pinene | 14896 | Click to see | 136.23 | unknown |
https://doi.org/10.1016/0031-9422(83)83016-7 https://doi.org/10.1080/10412905.1995.9698555 https://doi.org/10.1021/JF00023A054 |
| beta-Pinene, (+)- | 10290825 | Click to see | 136.23 | unknown | via CMAUP database |
| Bornyl acetate, (-)- | 93009 | Click to see | 196.29 | unknown | via CMAUP database |
| Camphene | 6616 | Click to see | 136.23 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| Npc126240 | 44630108 | Click to see | 196.29 | unknown | via CMAUP database |
| Sabinene | 18818 | Click to see | 136.23 | unknown |
https://doi.org/10.1080/10412905.1995.9698555 https://doi.org/10.1021/JF00023A054 |
| trans-alpha-Bergaptene | 6428986 | Click to see CC1=CCC2CC1C2(C)CCC=C(C)C | 204.35 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids | |||||
| (-)-Pulegone | 638012 | Click to see CC1CCC(=C(C)C)C(=O)C1 | 152.23 | unknown | via CMAUP database |
| (+-)-Piperitone | 6987 | Click to see | 152.23 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| (+) Menthol | 12285346 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | via CMAUP database |
| (+)-Limonene | 440917 | Click to see | 136.23 | unknown | https://doi.org/10.1021/NP200713Q |
| (+)-Menthol | 165675 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | via CMAUP database |
| (+)-Neomenthol | 439263 | Click to see | 156.26 | unknown | via CMAUP database |
| (3S,4R)-3-hydroxy-4-prop-1-en-2-ylcyclohexene-1-carbaldehyde | 10725727 | Click to see CC(=C)C1CCC(=CC1O)C=O | 166.22 | unknown | https://doi.org/10.1016/0031-9422(96)00378-0 |
| (L)-alpha-terpineol | 443162 | Click to see | 154.25 | unknown | via CMAUP database |
| [(4R)-4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol | 11788398 | Click to see CC(=C)C1CCC(=CC1)CO | 152.23 | unknown | via CMAUP database |
| 3-Hydroxy-p-mentha-1,8-dien-7-al | 85247137 | Click to see | 166.22 | unknown | https://doi.org/10.1016/0031-9422(96)00378-0 |
| 4-Isopropenylcyclohexene-1-carboxylic acid | 2724160 | Click to see CC(=C)C1CCC(=CC1)C(=O)O | 166.22 | unknown | https://doi.org/10.1021/NP200713Q |
| alpha-PHELLANDRENE | 7460 | Click to see CC1=CCC(C=C1)C(C)C | 136.23 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| Alpha-Terpineol | 17100 | Click to see | 154.25 | unknown | https://doi.org/10.1021/JF00023A054 |
| alpha-Terpinyl acetate | 111037 | Click to see CC1=CCC(CC1)C(C)(C)OC(=O)C | 196.29 | unknown | https://doi.org/10.1021/JF00023A054 |
| Carvone, (-)- | 439570 | Click to see | 150.22 | unknown | via CMAUP database |
| Carvone, (+-)- | 7439 | Click to see | 150.22 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| Carvone, (+)- | 16724 | Click to see CC1=CCC(CC1=O)C(=C)C | 150.22 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| Cyclohexane, 1-methylene-4-(1-methylethenyl)- | 68140 | Click to see | 136.23 | unknown | https://doi.org/10.1021/JF00023A054 |
| Dihydrocarvyl acetate | 30248 | Click to see CC1CCC(CC1OC(=O)C)C(=C)C | 196.29 | unknown | via CMAUP database |
| Isodihydrocarveol acetate | 1268040 | Click to see CC1CCC(CC1OC(=O)C)C(=C)C | 196.29 | 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 |
| Limonene, (-)- | 439250 | Click to see | 136.23 | unknown | https://doi.org/10.1016/0031-9422(86)80017-6 |
| Limonene, (+/-)- | 22311 | Click to see CC1=CCC(CC1)C(=C)C | 136.23 | unknown |
https://doi.org/10.1016/0031-9422(83)83016-7 https://doi.org/10.1021/NP200713Q https://doi.org/10.1021/JF00023A054 https://doi.org/10.1080/10412905.1995.9698555 https://doi.org/10.1016/0031-9422(91)83022-D |
| Menthol | 1254 | Click to see | 156.26 | unknown | via CMAUP database |
| Menthone | 26447 | Click to see | 154.25 | 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-Mentha-1,3,8-triene | 176983 | Click to see CC1=CC=C(CC1)C(=C)C | 134.22 | unknown | via CMAUP database |
| Perilla alcohol | 369312 | Click to see CC(=C)C1CCC(=CC1)CO | 152.23 | unknown |
https://doi.org/10.1021/NP200713Q https://doi.org/10.1021/JF00023A054 |
| Perillaldehyde | 16441 | Click to see CC(=C)C1CCC(=CC1)C=O | 150.22 | unknown |
https://doi.org/10.1201/9781351074940 https://doi.org/10.1002/(SICI)1099-1026(1998070)13:4<221::AID-FFJ716>3.0.CO;2-Z https://doi.org/10.1080/10412905.2007.9699213 https://doi.org/10.1016/0031-9422(86)80017-6 https://doi.org/10.1021/JF00023A054 https://doi.org/10.1246/NIKKASHI1921.64.845 https://doi.org/10.1248/CPB.34.1672 https://doi.org/10.1021/NP200713Q https://doi.org/10.1016/S0031-9422(00)83738-3 https://doi.org/10.1002/CBER.19110440107 |
| Perillaldehyde, (-)- | 2724159 | Click to see CC(=C)C1CCC(=CC1)C=O | 150.22 | unknown |
https://doi.org/10.1248/CPB.34.1672 https://doi.org/10.1007/BF01898448 |
| Perillaldehyde, (+)- | 1548901 | Click to see | 150.22 | unknown | https://doi.org/10.1002/CBER.19110440107 |
| Perillic Acid | 1256 | Click to see | 166.22 | unknown | https://doi.org/10.1021/NP200713Q |
| Perillyl alcohol | 10819 | Click to see CC(=C)C1CCC(=CC1)CO | 152.23 | unknown | https://doi.org/10.1021/JF00023A054 |
| Pulegone | 442495 | Click to see CC1CCC(=C(C)C)C(=O)C1 | 152.23 | unknown | https://doi.org/10.1021/JF00023A054 |
| Terpinolene | 11463 | Click to see | 136.23 | unknown | https://doi.org/10.1021/JF00023A054 |
| > Lipids and lipid-like molecules / Prenol lipids / Quinone and hydroquinone lipids / Vitamin E compounds / Tocopherols | |||||
| (+)-gamma-Tocopherol | 92729 | Click to see | 416.70 | unknown | via CMAUP database |
| Alpha-Tocopherol | 14985 | Click to see CC1=C(C2=C(CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C)C(=C1O)C)C | 430.70 | unknown | via CMAUP database |
| Delta-Tocopherol | 92094 | Click to see CC1=CC(=CC2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)O | 402.70 | unknown | via CMAUP database |
| DL-alpha-Tocopherol | 2116 | Click to see | 430.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids | |||||
| (-)-alpha-Curcumene | 442360 | Click to see | 202.33 | unknown |
https://doi.org/10.1271/BBB1961.50.2915 https://doi.org/10.1271/BBB.57.792 |
| (-)-Isocaryophyllene | 5281522 | Click to see | 204.35 | unknown | via CMAUP database |
| (+)-beta-Caryophyllene | 20831623 | Click to see | 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 |
| (1E,8E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene | 134687947 | Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C | 204.35 | unknown | https://doi.org/10.1021/JF00023A054 |
| (1R,2S,7S,8S)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene | 92042749 | Click to see CC1=CCC2C3C1C2(CCC3C(C)C)C | 204.35 | unknown |
https://doi.org/10.1080/10412905.1995.9698555 https://doi.org/10.1016/0031-9422(83)83016-7 |
| (1R,4R,5R,9S)-4,5-epoxycaryophyllan-8(13)-ene | 1742211 | Click to see | 220.35 | unknown | via CMAUP database |
| (3R,6E)-Nerolidol | 11241545 | Click to see | 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 |
| (4Z)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene | 5322111 | Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C | 204.35 | unknown | via CMAUP database |
| (E,Z)-farnesol | 1549109 | Click to see CC(=CCCC(=CCCC(=CCO)C)C)C | 222.37 | unknown | https://doi.org/10.1271/BBB.57.792 |
| (R)-beta-bisabolene | 68128 | Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C | 204.35 | unknown |
https://doi.org/10.1271/BBB1961.50.2915 https://doi.org/10.1271/BBB.57.792 |
| (Z)-caryophyllene | 6429301 | Click to see | 204.35 | unknown | via CMAUP database |
| (Z)2,(E)4,(E)6-Allofarnesene | 6429217 | Click to see | 204.35 | unknown | https://doi.org/10.1246/BCSJ.42.3615 |
| 1-Methyl-4-(1,2,2-trimethylcyclopentyl)benzene | 519346 | Click to see | 202.33 | unknown |
https://doi.org/10.1271/BBB1961.48.3141 https://doi.org/10.1271/BBB.57.792 |
| 1,4,8-Cycloundecatriene, 2,6,6,9-tetramethyl-, (1E,4E,8E)- | 23204 | Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C | 204.35 | unknown | https://doi.org/10.1002/JCCS.196000004 |
| 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl- | 8888 | Click to see | 222.37 | 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 |
| 2,6,6,9-Tetramethyl-cycloundeca-1,4,8-triene | 6508206 | Click to see | 204.35 | unknown | https://doi.org/10.1002/JCCS.196000004 |
| 2E,4E,6E-Allofarnesene | 11637048 | Click to see | 204.35 | unknown | https://doi.org/10.1246/BCSJ.42.3615 |
| 3a-Methyl-6-methylidene-1-(propan-2-yl)decahydrocyclobuta(1,2-a:3,4-a')dicyclopentene | 324224 | Click to see | 204.35 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| 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 |
| 4,12,12-Trimethyl-9-methylene-5-oxatricyclo(8.2.0.04,6)dodecane | 14350 | Click to see | 220.35 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| 7,11-Dimethyl-3-methylene-1,6,10-dodecatriene | 10407 | Click to see | 204.35 | unknown | via CMAUP database |
| a Farnesol | 3327 | Click to see | 222.37 | unknown | https://doi.org/10.1271/BBB.57.792 |
| alpha-IONONE | 5282108 | Click to see CC1=CCCC(C1C=CC(=O)C)(C)C | 192.30 | unknown | https://doi.org/10.1016/0031-9422(83)83016-7 |
| beta Farnesene | 15228937 | Click to see | 206.37 | unknown | https://doi.org/10.1271/BBB.57.792 |
| Beta-Bisabolene | 10104370 | Click to see CC1=CCC(CC1)C(=C)CCC=C(C)C | 204.35 | unknown |
https://doi.org/10.1271/BBB.57.792 https://doi.org/10.1271/BBB1961.50.2915 |
| beta-Bourbonene | 62566 | Click to see | 204.35 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| beta-Farnesene | 5281517 | Click to see CC(=CCCC(=CCCC(=C)C=C)C)C | 204.35 | unknown | https://doi.org/10.1021/JF00023A054 |
| beta-Farnesene, (6Z)- | 5317319 | Click to see CC(=CCCC(=CCCC(=C)C=C)C)C | 204.35 | unknown | via CMAUP database |
| beta-Turmerone | 196216 | Click to see | 218.33 | unknown | via CMAUP database |
| Cadin-4-en-10-ol | 519662 | Click to see | 222.37 | unknown | via CMAUP database |
| Cadina-1(10),4-diene | 10223 | Click to see CC1=CC2C(CCC(=C2CC1)C)C(C)C | 204.35 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| Caryophyllene | 5281515 | Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C | 204.35 | unknown |
https://doi.org/10.1016/0031-9422(83)83016-7 https://doi.org/10.1021/JF00023A054 https://doi.org/10.1080/10412905.1995.9698555 |
| Caryophyllene oxide | 1742210 | Click to see | 220.35 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| Caryophyllene,alpha + beta mixt. | 5354499 | Click to see | 204.35 | unknown | https://doi.org/10.1016/0031-9422(83)83016-7 |
| cis-Nerolidol | 5320128 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| cis,cis-Farnesol | 1549107 | Click to see CC(=CCCC(=CCCC(=CCO)C)C)C | 222.37 | unknown | via CMAUP database |
| Copaene | 19725 | Click to see CC1=CCC2C3C1C2(CCC3C(C)C)C | 204.35 | unknown |
https://doi.org/10.1080/10412905.1995.9698555 https://doi.org/10.1016/0031-9422(83)83016-7 |
| Cuparene | 86895 | Click to see | 202.33 | unknown |
https://doi.org/10.1271/BBB1961.48.3141 https://doi.org/10.1271/BBB.57.792 |
| Curcumene | 92139 | Click to see | 202.33 | unknown |
https://doi.org/10.1271/BBB.57.792 https://doi.org/10.1271/BBB1961.50.2915 |
| delta-Amorphene | 12306059 | Click to see | 204.35 | unknown | via CMAUP database |
| delta-Cadinene | 441005 | Click to see | 204.35 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| Elixene | 94254 | Click to see | 204.35 | unknown | via CMAUP database |
| Farnesene | 5281516 | Click to see | 204.35 | unknown |
https://doi.org/10.1021/JF00023A054 https://doi.org/10.1271/BBB.57.792 |
| Humulene | 5281520 | Click to see | 204.35 | unknown |
https://doi.org/10.1080/10412905.1995.9698555 https://doi.org/10.1021/JF00023A054 |
| I2-Ionone | 638014 | Click to see | 192.30 | unknown | via CMAUP database |
| Neophytadiene | 10446 | Click to see CC(C)CCCC(C)CCCC(C)CCCC(=C)C=C | 278.50 | unknown | via CMAUP database |
| Nerolidol | 5284507 | Click to see | 222.37 | unknown | via CMAUP database |
| Npc16157 | 13240188 | Click to see | 220.35 | unknown | via CMAUP database |
| Npc294136 | 14757966 | Click to see | 204.35 | unknown | via CMAUP database |
| Npc57877 | 6431302 | Click to see | 222.37 | unknown | via CMAUP database |
| Npc91574 | 12306054 | Click to see | 204.35 | unknown | via CMAUP database |
| Sesquichamene | 97829 | Click to see | 204.35 | unknown |
https://doi.org/10.1271/BBB1961.50.2915 https://doi.org/10.1271/BBB.57.792 |
| tau-Muurolol | 6432221 | Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C | 222.37 | unknown | via CMAUP database |
| Thujopsene | 442402 | Click to see | 204.35 | unknown |
https://doi.org/10.1271/BBB1961.50.2915 https://doi.org/10.1271/BBB.57.792 |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids | |||||
| (1aS,4aS,7aS,7bR)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene | 91746456 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C | 204.35 | unknown | https://doi.org/10.1021/JF00023A054 |
| 1H-Cycloprop(e)azulene, decahydro-1,1,7-trimethyl-4-methylene-, (1aR-(1aalpha,4abeta,7alpha,7abeta,7balpha))- | 91354 | Click to see | 204.35 | unknown | https://doi.org/10.1021/JF00023A054 |
| 1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1ar-(1aalpha,4aalpha,7beta,7abeta,7balpha)]- | 6432640 | Click to see CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C | 220.35 | unknown | via CMAUP database |
| beta-Spathulenol | 522266 | Click to see | 220.35 | unknown | via CMAUP database |
| Npc143639 | 6432706 | Click to see | 220.35 | unknown | via CMAUP database |
| Spathulenol | 92231 | Click to see CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C | 220.35 | unknown | via CMAUP database |
| Spathulenol, (-)- | 13854255 | Click to see | 220.35 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids | |||||
| (1S,2R,4R)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane | 6431152 | Click to see | 204.35 | unknown | via CMAUP database |
| Beta-Elemene | 6918391 | Click to see | 204.35 | unknown |
https://doi.org/10.1080/10412905.1995.9698555 https://doi.org/10.1016/0031-9422(83)83016-7 |
| Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1R,2R,4S)- | 9859094 | Click to see | 204.35 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Germacrane sesquiterpenoids | |||||
| (+)-Germacrene D | 24771782 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| (1E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene | 74764030 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| (1Z)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene | 92003564 | Click to see | 204.35 | unknown | via CMAUP database |
| (3R,6E,10S)-6,10-dimethyl-3-(propan-2-yl)cyclodec-6-ene-1,4-dione | 10466651 | Click to see | 236.35 | unknown | via CMAUP database |
| (6E,8S)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene | 49796490 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| (S,1Z,6Z)-8-Isopropyl-1-methyl-5-methylenecyclodeca-1,6-diene | 91723653 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| 1-Methyl-5-methylene-8-(1-methylethyl)-1,6-cyclodecadiene | 6436582 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| 1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)- | 5373727 | Click to see | 204.35 | unknown | via CMAUP database |
| Germacrene D | 5317570 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| Germacrone | 6436348 | Click to see | 218.33 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides | |||||
| (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methoxy]oxane-3,4,5-triol | 102508931 | Click to see | 314.37 | unknown | via CMAUP database |
| (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]methoxy]oxane-3,4,5-triol | 10086989 | Click to see | 314.37 | unknown | via CMAUP database |
| [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4S)-4-prop-1-en-2-ylcyclohexene-1-carboxylate | 21631012 | Click to see CC(=C)C1CCC(=CC1)C(=O)OC2C(C(C(C(O2)CO)O)O)O | 328.36 | unknown | https://doi.org/10.1016/S0031-9422(00)90843-4 |
| 2-(Hydroxymethyl)-6-[(4-prop-1-en-2-ylcyclohexen-1-yl)methoxy]oxane-3,4,5-triol | 73745655 | Click to see CC(=C)C1CCC(=CC1)COC2C(C(C(C(O2)CO)O)O)O | 314.37 | unknown | https://doi.org/10.1016/0031-9422(92)83490-P |
| Perilloside A | 3086657 | Click to see | 314.37 | unknown | https://doi.org/10.1016/0031-9422(92)83490-P |
| Perilloside B | 73815069 | Click to see | 328.36 | unknown | https://doi.org/10.1016/S0031-9422(00)90843-4 |
| Perilloside C | 73815070 | Click to see | 316.39 | unknown | https://doi.org/10.1016/S0031-9422(00)90843-4 |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Diterpene lactones | |||||
| Dihydrohalichondramide | 10259927 | Click to see | 839.00 | unknown | https://doi.org/10.1016/S0031-9422(00)90843-4 |
| > Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Carotenes | |||||
| Beta-Carotene | 5280489 | Click to see | 536.90 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Xanthophylls | |||||
| (1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1R)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-3,5,5-trimethylcyclohex-3-en-1-ol | 6433159 | Click to see CC1=C(C(CC(C1)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2C(=CC(CC2(C)C)O)C)C)C | 568.90 | unknown | via CMAUP database |
| (1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-3,5,5-trimethylcyclohex-3-en-1-ol | 25245095 | Click to see | 568.90 | unknown | via CMAUP database |
| (1S)-4-[(1E,3Z,5E,7Z,9E,11Z,13E,15Z,17E)-18-[(1R)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-3,5,5-trimethylcyclohex-3-en-1-ol | 102514741 | Click to see | 568.90 | unknown | via CMAUP database |
| (3R,3'R,6S)-4,5-Didehydro-5,6-dihydro-beta,beta-carotene-3,3'-diol | 448437 | Click to see | 568.90 | unknown | via CMAUP database |
| 4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-(4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]-3,5,5-trimethylcyclohex-2-en-1-ol | 5368396 | Click to see CC1=C(C(CC(C1)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2C(=CC(CC2(C)C)O)C)C)C | 568.90 | unknown | via CMAUP database |
| 4-[18-(4-Hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]-3,5,5-trimethylcyclohex-3-en-1-ol | 181579 | Click to see CC1=C(C(CC(C1)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC2C(=CC(CC2(C)C)O)C)C)C | 568.90 | unknown | via CMAUP database |
| Lutein A | 5281243 | Click to see | 568.90 | unknown | via CMAUP database |
| Violaxanthin | 448438 | Click to see | 600.90 | unknown | via CMAUP database |
| Zeaxanthin | 5280899 | Click to see | 568.90 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Triterpenoids | |||||
| (+)-Ursolic Acid | 64945 | Click to see | 456.70 | unknown |
https://doi.org/10.1271/BBB.68.85 https://doi.org/10.1039/C39850001087 |
| (10R)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid | 45358157 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O | 456.70 | unknown | via CMAUP database |
| (1S,2R,4aR,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid | 45483617 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O | 456.70 | unknown | via CMAUP database |
| (4aR,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 45483610 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C | 456.70 | unknown | via CMAUP database |
| 1,10-Dihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid | 3838010 | Click to see | 472.70 | unknown | https://doi.org/10.1271/BBB.68.85 |
| 2,3-Dihydroxy-12-oleanen-28-oic acid | 3694932 | Click to see | 472.70 | unknown | https://doi.org/10.1271/BBB.68.85 |
| 3-Epicorosolic acid | 15917998 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1C)C)C(=O)O | 472.70 | unknown | https://doi.org/10.1271/BBB.68.85 |
| 3-Epioleanolic acid | 11869658 | Click to see | 456.70 | unknown | via CMAUP database |
| 3-Hydroxyolean-12-en-28-oic acid | 619166 | Click to see | 456.70 | unknown | https://doi.org/10.1271/BBB.68.85 |
| Augustic Acid | 15560128 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)O)C | 472.70 | unknown | https://doi.org/10.1271/BBB.68.85 |
| Colosolic acid | 15917996 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1C)C)C(=O)O | 472.70 | unknown | https://doi.org/10.1271/BBB.68.85 |
| Corosolic acid | 6918774 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1C)C)C(=O)O | 472.70 | unknown | https://doi.org/10.1271/BBB.68.85 |
| epi-Maslinic acid | 25564831 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)O)C | 472.70 | unknown | https://doi.org/10.1271/BBB.68.85 |
| Jacarandic acid | 13653335 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1(C)O)C)C(=O)O | 488.70 | unknown |
https://doi.org/10.1016/0031-9422(94)85096-8 https://doi.org/10.1271/BBB.68.85 |
| Oleanolic Acid | 10494 | Click to see | 456.70 | unknown | https://doi.org/10.1271/BBB.68.85 |
| Pomolic acid | 382831 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1(C)O)C)C(=O)O | 472.70 | unknown |
https://doi.org/10.1271/BBB.68.85 https://doi.org/10.1007/S11418-006-0015-9 |
| Tormentic acid | 73193 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1(C)O)C)C(=O)O | 488.70 | unknown |
https://doi.org/10.1271/BBB.68.85 https://doi.org/10.1016/0031-9422(94)85096-8 |
| Urs-12-en-28-oic acid, 3-hydroxy-, (3beta)- | 220774 | Click to see | 456.70 | unknown | https://doi.org/10.1271/BBB.68.85 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Bile acids, alcohols and derivatives / Hydroxy bile acids, alcohols and derivatives / Tetrahydroxy bile acids, alcohols and derivatives | |||||
| Castasterone | 133534 | Click to see CC(C)C(C)C(C(C(C)C1CCC2C1(CCC3C2CC(=O)C4C3(CC(C(C4)O)O)C)C)O)O | 464.70 | unknown | https://doi.org/10.1271/BBB.58.2241 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids | |||||
| (1S,4R,5S,8S,10R,13R,14R,17R)-17-[(2R,5R)-5,6-dimethylhept-3-en-2-yl]-5-methyl-19-oxapentacyclo[11.4.2.01,14.04,13.05,10]nonadec-11-ene-4,8,10-triol | 139586460 | Click to see | 444.60 | unknown |
https://doi.org/10.1271/BBB1961.54.1745 https://doi.org/10.1271/BBB1961.53.1971 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives | |||||
| (24R)-5-Ergosten-3beta-ol | 312822 | Click to see | 400.70 | unknown | https://doi.org/10.1248/CPB.34.1672 |
| 22,23-Dihydrobrassicasterol | 5283637 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 400.70 | unknown | via CMAUP database |
| Campesterol | 173183 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 400.70 | unknown | https://doi.org/10.1248/CPB.34.1672 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Estrane steroids / Estrogens and derivatives | |||||
| Estrone | 5870 | Click to see | 270.40 | unknown | https://doi.org/10.1016/S0044-328X(72)80100-4 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Pregnane steroids / Gluco/mineralocorticoids, progestogins and derivatives | |||||
| Progesterone | 5994 | Click to see | 314.50 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid acids / 3-carboxy steroids | |||||
| 11-hydroxy-1-(hydroxymethyl)-3,3,5a,5b,10,11,13b-heptamethyl-4,5,6,7,8,9,10,11a,13,13a-decahydro-3aH-cyclopenta[a]chrysene-7a-carboxylic acid | 14605532 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(C(=CC5(C)C)CO)C)C)C2C1(C)O)C)C(=O)O | 470.70 | unknown | https://doi.org/10.1271/BBB.68.85 |
| Hyptadienic acid | 14605533 | Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(C(=CC5(C)C)CO)C)C)C2C1(C)O)C)C(=O)O | 470.70 | unknown |
https://doi.org/10.1007/S11418-006-0015-9 https://doi.org/10.1271/BBB.68.85 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives | |||||
| (-)-beta-Sitosterol | 222284 | Click to see | 414.70 | unknown | https://doi.org/10.1248/CPB.34.1672 |
| 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/10.1248/CPB.34.1672 |
| 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/10.1248/CPB.34.1672 |
| beta-Sitosterol 3-O-beta-D-galactopyranoside | 296119 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C | 576.80 | unknown | https://doi.org/10.1016/S0031-9422(00)90843-4 |
| Sitogluside | 5742590 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C | 576.80 | unknown | https://doi.org/10.1016/S0031-9422(00)90843-4 |
| Stigmasterol | 5280794 | Click to see | 412.70 | unknown | https://doi.org/10.1248/CPB.34.1672 |
| > Organic acids and derivatives / Carbothioic S-acids | |||||
| pentadecanethioic S-acid | 18413781 | Click to see | 258.50 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alanine and derivatives | |||||
| Octopinic acid | 13748388 | Click to see CC(C(=O)O)NC(CCCN)C(=O)O | 204.22 | unknown | via CMAUP database |
| > Organic acids and derivatives / Hydroxy acids and derivatives / Medium-chain hydroxy acids and derivatives | |||||
| (r)-(-)-3-Hydroxy-5-phenylvaleric acid | 9815528 | Click to see C1=CC=C(C=C1)CCC(CC(=O)O)O | 194.23 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organic oxides | |||||
| beta-Cyclocitral | 9895 | Click to see | 152.23 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives | |||||
| Chlorogenic Acid | 1794427 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | via CMAUP database |
| cis-Chlorogenic acid | 1794425 | Click to see | 354.31 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Primary alcohols | |||||
| (Z)-2-Penten-1-ol | 5364919 | Click to see | 86.13 | unknown | via CMAUP database |
| 2-Penten-1-ol | 5364920 | Click to see | 86.13 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols | |||||
| (3R)-hept-1-en-3-ol | 7269382 | Click to see | 114.19 | unknown | via CMAUP database |
| (R)-1-Pentene-3-ol | 6994331 | Click to see | 86.13 | unknown | via CMAUP database |
| 1-Penten-3-Ol | 12020 | Click to see | 86.13 | unknown | via CMAUP database |
| 2-Hexanol | 12297 | Click to see | 102.17 | unknown | https://doi.org/10.1021/JF00023A054 |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Cyanogenic glycosides | |||||
| (2R)-2-phenyl-2-[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyacetonitrile | 92450246 | Click to see | 295.29 | unknown | via CMAUP database |
| (2R)-2-phenyl-2-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyacetonitrile | 154497290 | Click to see C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O | 295.29 | unknown | https://doi.org/10.1016/S0031-9422(00)83060-5 |
| 2-Phenyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyacetonitrile | 576072 | Click to see | 295.29 | unknown |
https://doi.org/10.1016/S0031-9422(00)83060-5 https://doi.org/10.1016/0031-9422(94)85096-8 https://doi.org/10.1271/BBB.60.732 |
| Eucalyptosin A | 123133484 | Click to see | 457.40 | unknown | https://doi.org/10.1016/S0031-9422(00)83060-5 |
| Mandelonitrile sophoroside | 14298910 | Click to see | 457.40 | unknown | https://doi.org/10.1016/S0031-9422(00)83060-5 |
| Prunasin | 119033 | Click to see C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O | 295.29 | unknown |
https://doi.org/10.1016/0031-9422(94)85096-8 https://doi.org/10.1016/S0031-9422(00)83060-5 |
| Sambunigrin | 91434 | Click to see C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O | 295.29 | unknown |
https://doi.org/10.1016/S0031-9422(00)83060-5 https://doi.org/10.1016/0031-9422(94)85096-8 https://doi.org/10.1271/BBB.60.732 |
| Vicianin | 656493 | Click to see C1C(C(C(C(O1)OCC2C(C(C(C(O2)OC(C#N)C3=CC=CC=C3)O)O)O)O)O)O | 427.40 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds | |||||
| 2-(Hydroxymethyl)-6-phenylmethoxyoxane-3,4,5-triol | 4984739 | Click to see | 270.28 | unknown | https://doi.org/10.1016/0031-9422(94)85096-8 |
| Benzyl Alpha-D-Mannopyranoside | 10956572 | Click to see | 270.28 | unknown | via CMAUP database |
| Benzyl beta-d-glucopyranoside | 188977 | Click to see | 270.28 | unknown | https://doi.org/10.1016/0031-9422(94)85096-8 |
| GlyTouCan:G29155XH | 91692850 | Click to see | 342.30 | unknown | via CMAUP database |
| GlyTouCan:G80014NW | 46782954 | Click to see | 342.30 | unknown | via CMAUP database |
| Methyl alpha-D-galactopyranoside | 76935 | Click to see COC1C(C(C(C(O1)CO)O)O)O | 194.18 | unknown | https://doi.org/10.1271/BBB.60.732 |
| Methyl beta-D-galactopyranoside | 2108 | Click to see COC1C(C(C(C(O1)CO)O)O)O | 194.18 | unknown | https://doi.org/10.1271/BBB.60.732 |
| Sucrose | 5988 | Click to see | 342.30 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides | |||||
| (2R,3S,4R,5R,6S)-2-(hydroxymethyl)-6-(5-methoxy-6-prop-2-enyl-1,3-benzodioxol-4-yl)oxane-3,4,5-triol | 5319623 | Click to see | 354.40 | unknown | via CMAUP database |
| (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(2-methoxy-5-prop-2-enylphenoxy)oxane-3,4,5-triol | 21579141 | Click to see COC1=C(C=C(C=C1)CC=C)OC2C(C(C(C(O2)CO)O)O)O | 326.34 | unknown | https://doi.org/10.1016/0031-9422(94)85096-8 |
| 2-(Hydroxymethyl)-6-(2-methoxy-5-prop-2-enylphenoxy)oxane-3,4,5-triol | 73803891 | Click to see COC1=C(C=C(C=C1)CC=C)OC2C(C(C(C(O2)CO)O)O)O | 326.34 | unknown | https://doi.org/10.1016/0031-9422(94)85096-8 |
| 2-(Hydroxymethyl)-6-[(5-methoxy-6-prop-2-enyl-1,3-benzodioxol-4-yl)oxy]oxane-3,4,5-triol | 75306307 | Click to see | 370.40 | unknown | https://doi.org/10.1016/0031-9422(94)85096-8 |
| 3-(2-Glucosyloxy-4-methoxyphenyl)propanoic acid | 11100427 | Click to see COC1=CC(=C(C=C1)CCC(=O)O)OC2C(C(C(C(O2)CO)O)O)O | 358.34 | unknown | https://doi.org/10.1271/BBB.60.1093 |
| 3-Hydroxytyrosol 3-O-glucoside | 5315870 | Click to see | 316.30 | unknown | via CMAUP database |
| Caffeic acid 3-(beta-1-glucoside) | 442776 | Click to see | 342.30 | unknown | via CMAUP database |
| Citrusin C | 3084296 | Click to see | 326.34 | unknown | https://doi.org/10.1016/0031-9422(92)83490-P |
| Eugenol glucoside | 9945189 | Click to see | 326.34 | unknown | https://doi.org/10.1016/0031-9422(92)83490-P |
| Perilloside E | 49855080 | Click to see COC1=C(C2=C(C=C1CC=C)OCO2)OC3C(C(C(C(O3)CO)O)O)O | 370.40 | unknown | https://doi.org/10.1016/0031-9422(94)85096-8 |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Alpha-hydrogen aldehydes | |||||
| (Z)-3-pentenal | 12585767 | Click to see | 84.12 | unknown | via CMAUP database |
| 3-Pentenal | 111089 | Click to see | 84.12 | unknown | via CMAUP database |
| Pent-3-enal | 5463339 | Click to see CC=CCC=O | 84.12 | unknown | via CMAUP database |
| Propionaldehyde | 527 | Click to see CCC=O | 58.08 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes | |||||
| (Z)-non-2-enal | 5354833 | Click to see | 140.22 | unknown | via CMAUP database |
| 2-Hexenal, (2Z)- | 6428782 | Click to see | 98.14 | unknown | via CMAUP database |
| 2,4-Heptadienal | 5283321 | Click to see CCC=CC=CC=O | 110.15 | unknown | via CMAUP database |
| 2,4-Hexadienal | 637564 | Click to see | 96.13 | unknown | via CMAUP database |
| 3-Hexenal | 643139 | Click to see | 98.14 | unknown | via CMAUP database |
| cis-3-Hexenal | 643941 | Click to see CCC=CCC=O | 98.14 | unknown | via CMAUP database |
| Hex-3-enal | 23234 | Click to see | 98.14 | unknown | https://doi.org/10.1016/0031-9422(83)83016-7 |
| Hexanal | 6184 | Click to see | 100.16 | unknown | via CMAUP database |
| trans-2-Hexenal | 5281168 | Click to see | 98.14 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Enones | |||||
| 1-Octen-3-one | 61346 | Click to see | 126.20 | unknown | via CMAUP database |
| 1-Penten-3-one | 15394 | Click to see | 84.12 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aryl ketones | |||||
| 1-(Furan-3-yl)-4-methylpent-2-en-1-one | 169595 | Click to see | 164.20 | unknown | https://doi.org/10.1248/YAKUSHI1947.84.11_1123 |
| Dehydroelsholtzia ketone | 564412 | Click to see | 164.20 | unknown | https://doi.org/10.1016/0031-9422(86)80017-6 |
| Isoegomaketone | 5318556 | Click to see CC(C)C=CC(=O)C1=COC=C1 | 164.20 | unknown |
https://doi.org/10.1016/0031-9422(86)80017-6 https://doi.org/10.1016/0031-9422(83)83016-7 https://doi.org/10.1055/S-2006-961996 https://doi.org/10.1248/YAKUSHI1947.84.11_1123 https://doi.org/10.1016/S0031-9422(00)84531-8 |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aryl ketones / Aryl alkyl ketones | |||||
| 1-(3-Furyl)-4-methyl-1-pentanone | 68381 | Click to see | 166.22 | unknown |
https://doi.org/10.1246/NIKKASHI1921.64.1130 https://doi.org/10.1055/S-2007-969568 https://doi.org/10.1248/JHS1956.36.320 https://doi.org/10.1016/J.BMC.2008.12.057 https://doi.org/10.1055/S-2006-961996 https://doi.org/10.1248/YAKUSHI1947.84.11_1123 https://doi.org/10.1016/0031-9422(86)80017-6 https://doi.org/10.1016/0031-9422(83)83016-7 |
| 1-(3-Methyl-2-furanyl)ethanone | 12281224 | Click to see | 124.14 | unknown | via CMAUP database |
| 2-Furyl pentyl ketone | 61738 | Click to see | 166.22 | unknown | via CMAUP database |
| Egomaketone | 42978 | Click to see | 164.20 | unknown | via CMAUP database |
| Elsholtziaketone | 521240 | Click to see | 166.22 | unknown | https://doi.org/10.1016/0031-9422(86)80017-6 |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzaldehydes / Hydroxybenzaldehydes | |||||
| 3,4-Dihydroxybenzaldehyde | 8768 | Click to see | 138.12 | unknown |
https://doi.org/10.1271/BBB.60.732 https://doi.org/10.1271/BBB.60.1093 |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones | |||||
| 3-Octanone | 246728 | Click to see CCCCCC(=O)CC | 128.21 | unknown | https://doi.org/10.1080/10412905.1995.9698555 |
| 3-Pentanone | 7288 | Click to see CCC(=O)CC | 86.13 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Benzodioxoles | |||||
| Apiole | 10659 | Click to see | 222.24 | unknown | via CMAUP database |
| Dillapiol | 10231 | Click to see COC1=C(C2=C(C=C1CC=C)OCO2)OC | 222.24 | unknown |
https://doi.org/10.1248/CPB.36.3153 https://doi.org/10.1016/0031-9422(86)80017-6 https://doi.org/10.1016/0031-9422(86)80070-X |
| Myristicin | 4276 | Click to see | 192.21 | unknown |
https://doi.org/10.1016/0031-9422(86)80017-6 https://doi.org/10.1016/0031-9422(83)83016-7 https://doi.org/10.1016/0031-9422(86)80070-X https://doi.org/10.1248/CPB.36.3153 |
| Nothoapiole | 185518 | Click to see | 252.26 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Benzoxepines | |||||
| 2-(5-Methoxy-2,3-dihydrofuro[3,2-i][3]benzoxepin-2-yl)propan-2-ol | 21603445 | Click to see | 274.31 | unknown | https://doi.org/10.1021/NP990362O |
| 5-Methoxyfuro[2,3-g][3]benzoxepin | 10084612 | Click to see CC(C)(C1=CC2=CC(=C3C=COC=CC3=C2O1)OC)O | 272.29 | unknown | https://doi.org/10.1021/NP990362O |
| Perilloxin | 10468570 | Click to see CC(C)(C1CC2=CC(=C3C=COC=CC3=C2O1)OC)O | 274.31 | unknown | https://doi.org/10.1021/NP990362O |
| > Organoheterocyclic compounds / Diazines / Pyrazines | |||||
| 2-(Bromomethyl)pyrazine | 12752238 | Click to see C1=CN=C(C=N1)CBr | 173.01 | unknown | via CMAUP database |
| 2-Butyl-3-methylpyrazine | 85228 | Click to see | 150.22 | unknown | https://doi.org/10.1021/JF402487A |
| 2-Ethyl-3-Methylpyrazine | 27457 | Click to see | 122.17 | unknown | https://doi.org/10.1021/JF402487A |
| 2-Ethyl-3,5-dimethylpyrazine | 26334 | Click to see CCC1=NC=C(N=C1C)C | 136.19 | unknown | via CMAUP database |
| 2-Ethyl-5-methylpyrazine | 25915 | Click to see | 122.17 | unknown | via CMAUP database |
| 2-Ethyl-6-methylpyrazine | 26332 | Click to see CCC1=NC(=CN=C1)C | 122.17 | unknown | via CMAUP database |
| 2-Ethylpyrazine | 26331 | Click to see CCC1=NC=CN=C1 | 108.14 | unknown | https://doi.org/10.1021/JF402487A |
| 2-Isobutyl-3-methylpyrazine | 26333 | Click to see CC1=NC=CN=C1CC(C)C | 150.22 | unknown | https://doi.org/10.1021/JF402487A |
| 2-Methyl-3-propylpyrazine | 85224 | Click to see | 136.19 | unknown | https://doi.org/10.1021/JF402487A |
| 2-Methylpyrazine | 7976 | Click to see CC1=NC=CN=C1 | 94.11 | unknown | via CMAUP database |
| 2,3-Diethylpyrazine | 27458 | Click to see | 136.19 | unknown | via CMAUP database |
| 2,3-Dimethylpyrazine | 22201 | Click to see | 108.14 | unknown | via CMAUP database |
| 2,5-Dimethylpyrazine | 31252 | Click to see CC1=CN=C(C=N1)C | 108.14 | unknown | via CMAUP database |
| 2,6-Dimethylpyrazine | 7938 | Click to see | 108.14 | unknown | via CMAUP database |
| 3-Ethyl-2,5-dimethylpyrazine | 25916 | Click to see | 136.19 | unknown | via CMAUP database |
| Pyrazine | 9261 | Click to see C1=CN=CC=N1 | 80.09 | unknown | via CMAUP database |
| Tetramethylpyrazine | 14296 | Click to see | 136.19 | unknown | via CMAUP database |
| Trimethylpyrazine | 26808 | Click to see | 122.17 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Diazines / Pyrimidines and pyrimidine derivatives / Thiamines | |||||
| Thiamine | 1130 | Click to see | 265.36 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Epoxides | |||||
| (-)-Humulene epoxide II | 10704181 | Click to see | 220.35 | unknown | via CMAUP database |
| (1R,3E,7E,11S)-1,5,5,8-tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene | 12900740 | Click to see | 220.35 | unknown | via CMAUP database |
| 12-Oxabicyclo[9.1.0]dodeca-3,7-diene, 1,5,5,8-tetramethyl-, (1R,3E,7E,11R)- | 92476330 | Click to see | 220.35 | unknown | via CMAUP database |
| Humulene epoxide II | 23274265 | Click to see | 220.35 | unknown | via CMAUP database |
| Humulene epoxyde | 5463721 | Click to see | 220.35 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Heteroaromatic compounds | |||||
| Perillene | 68316 | Click to see | 150.22 | unknown | https://doi.org/10.1016/0031-9422(90)87094-B |
| > Organoheterocyclic compounds / Indoles and derivatives / Indolyl carboxylic acids and derivatives | |||||
| (2S)-2-ammonio-3-(1H-indol-3-yl)propanoate | 6923516 | Click to see | 204.22 | unknown | via CMAUP database |
| D-Tryptophan | 9060 | Click to see | 204.22 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Oxanes | |||||
| 1,8-Cineole | 2758 | Click to see | 154.25 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Oxepanes | |||||
| (+)-cis-Limonene 1,2-epoxide | 6432653 | Click to see CC(=C)C1CCC2(C(C1)O2)C | 152.23 | unknown | via CMAUP database |
| (+)-trans-Limonene oxide | 449290 | Click to see CC(=C)C1CCC2(C(C1)O2)C | 152.23 | unknown | via CMAUP database |
| Limonene oxide, cis- | 6432449 | Click to see CC(=C)C1CCC2(C(C1)O2)C | 152.23 | unknown | via CMAUP database |
| Limonene oxide, cis-(-)- | 6452061 | Click to see | 152.23 | unknown | via CMAUP database |
| Limonene oxide, trans-(-)- | 8029780 | Click to see | 152.23 | unknown | via CMAUP database |
| Limonene-1,2-epoxide | 441245 | Click to see | 152.23 | unknown | https://doi.org/10.1021/JF00023A054 |
| > Organoheterocyclic compounds / Oxolanes | |||||
| 2-Furanmethanol, 5-ethenyltetrahydro-alpha,alpha,5-trimethyl-, (2R,5R)-rel- | 6431475 | Click to see | 170.25 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Tetrahydrofurans | |||||
| trans-Linalool oxide | 6432254 | Click to see CC1(CCC(O1)C(C)(C)O)C=C | 170.25 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Tetrapyrroles and derivatives / Chlorins | |||||
| Chlorophyll | 5748352 | Click to see CCC1=C(C2=NC1=CC3=C(C4=C(C(C(=C4[N-]3)C5=NC(=CC6=NC(=C2)C(=C6C)C=C)C(C5CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C)C(=O)OC)[O-])C)C.[Mg+2] | 893.50 | unknown | via CMAUP database |
| Chlorophyll a from Chlorella | 16058064 | Click to see | 893.50 | unknown | via CMAUP database |
| CID 24201364 | 24201364 | Click to see | 909.50 | unknown | via CMAUP database |
| CID 46926108 | 46926108 | Click to see CCC1=C(C2=NC1=CC3=C(C4=C([N-]3)C(=C5C(C(C(=N5)C=C6C(=C(C(=C2)[N-]6)C=C)C)C)CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C(C4=O)C(=O)OC)C)C=O.[Mg+2] | 907.50 | unknown | via CMAUP database |
| CID 6477652 | 6477652 | Click to see | 893.50 | unknown | via CMAUP database |
| magnesium methyl (3R,21S,22S)-16-ethenyl-11-ethyl-12-formyl-17,21,26-trimethyl-4-oxo-22-[3-oxo-3-[(E,7S,11R)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,25-diazonia-7,24-diazanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaene-3-carboxylate | 42622157 | Click to see | 909.50 | unknown | via CMAUP database |
| magnesium methyl (3R,21S,22S)-16-ethenyl-11-ethyl-12,17,21,26-tetramethyl-4-oxo-22-[3-oxo-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,25-diaza-7,24-diazanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaene-3-carboxylate | 44602414 | Click to see | 893.50 | unknown | via CMAUP database |
| magnesium methyl (3S,21S,22S)-16-ethenyl-11-ethyl-12,17,21,26-tetramethyl-4-oxo-22-[3-oxo-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,25-diazonia-7,24-diazanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaene-3-carboxylate | 122361620 | Click to see | 895.50 | unknown | via CMAUP database |
| magnesium methyl 16-ethenyl-11-ethyl-12,17,21,26-tetramethyl-4-oxo-22-[3-oxo-3-[(Z)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,25-diazonia-7,24-diazanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaene-3-carboxylate | 23304731 | Click to see | 895.50 | unknown | via CMAUP database |
| magnesium;methyl (21S,22S)-16-ethenyl-11-ethyl-12-formyl-17,21,26-trimethyl-4-oxo-22-[3-oxo-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,25-diaza-7,24-diazanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaene-3-carboxylate | 46173742 | Click to see | 907.50 | unknown | via CMAUP database |
| magnesium;methyl (3R,21S,22S)-16-ethenyl-11-ethyl-12,17,21,26-tetramethyl-4-oxo-22-[3-oxo-3-[(E,7S,11R)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,25-diazonia-7,24-diazanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5,8(26),9,11,13(25),14,16,18,20(23)-decaene-3-carboxylate | 42618488 | Click to see CCC1=C(C2=[NH+]C1=CC3=C(C4=C([N-]3)C(=C5C(C(C(=[NH+]5)C=C6C(=C(C(=C2)[N-]6)C=C)C)C)CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C(C4=O)C(=O)OC)C)C.[Mg+2] | 895.50 | unknown | via CMAUP database |
| magnesium;methyl 16-ethenyl-11-ethyl-12-formyl-17,21,26-trimethyl-4-oxo-22-[3-oxo-3-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,25-diazonia-7,24-diazanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),5(26),8,10(25),11,13,15,17,19-decaene-3-carboxylate | 23644077 | Click to see CCC1=C(C2=[NH+]C1=CC3=C(C4=C([N-]3)C(=C5C(C(C(=[NH+]5)C=C6C(=C(C(=C2)[N-]6)C=C)C)C)CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C(C4=O)C(=O)OC)C)C=O.[Mg+2] | 909.50 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Tetrapyrroles and derivatives / Metallotetrapyrroles | |||||
| magnesium (3R,21S,22S)-16-ethenyl-11-ethyl-12-formyl-3-methoxycarbonyl-17,21,26-trimethyl-22-[3-oxo-3-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,24,25-triaza-7-azanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),4,8(26),9,11,13(25),14,16,18(24),19-undecaen-4-olate | 6477653 | Click to see | 907.50 | unknown | via CMAUP database |
| magnesium 16-ethenyl-11-ethyl-3-methoxycarbonyl-12,17,21,26-tetramethyl-22-[3-oxo-3-[(Z)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,24,25-triaza-7-azanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),4,8(26),9,11,13(25),14,16,18(24),19-undecaen-4-olate | 45109766 | Click to see | 893.50 | unknown | via CMAUP database |
| magnesium;[(21S,22S)-16-ethenyl-11-ethyl-3-methoxycarbonyl-17,21,26-trimethyl-4-oxo-22-[3-oxo-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,24,25-triaza-7-azanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),5(26),8,10,13(25),14,16,18(24),19-decaen-12-ylidene]methanolate | 44134476 | Click to see CCC1=C2C=C3C(=C4C(=O)C(C(=C4[N-]3)C5=NC(=CC6=NC(=CC(=N2)C1=C[O-])C(=C6C)C=C)C(C5CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C)C(=O)OC)C.[Mg+2] | 907.50 | unknown | via CMAUP database |
| Magnesium;[(3R,21S,22S)-16-ethenyl-11-ethyl-3-methoxycarbonyl-17,21,26-trimethyl-4-oxo-22-[3-oxo-3-[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,24,25-triaza-7-azanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),5(26),8,10,13(25),14,16,18(24),19-decaen-12-ylidene]methanolate | 6450186 | Click to see | 907.50 | unknown | via CMAUP database |
| magnesium;16-ethenyl-11-ethyl-12-formyl-3-methoxycarbonyl-17,21,26-trimethyl-22-[3-oxo-3-[(Z)-3,7,11,15-tetramethylhexadec-2-enoxy]propyl]-23,24,25-triaza-7-azanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),4,8(26),9,11,13(25),14,16,18(24),19-undecaen-4-olate | 45109779 | Click to see CCC1=C(C2=NC1=CC3=C(C4=C(C(C(=C4[N-]3)C5=NC(=CC6=NC(=C2)C(=C6C)C=C)C(C5CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C)C(=O)OC)[O-])C)C=O.[Mg+2] | 907.50 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Cinnamic acids and derivatives | |||||
| 1-Octen-3-one, (E)- | 5995948 | Click to see | 216.32 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives | |||||
| (3R)-3-(3,4-dihydroxyphenyl)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropanoic acid | 163185213 | Click to see C1=CC(=C(C=C1C=CC(=O)OC(CC(=O)O)C2=CC(=C(C=C2)O)O)O)O | 360.30 | unknown | https://doi.org/10.1271/BBB.60.732 |
| (4-Prop-1-en-2-ylcyclohexyl)methyl 3-(3,4-dihydroxyphenyl)prop-2-enoate | 70152895 | Click to see | 316.40 | unknown | https://doi.org/10.1271/BBB.60.1093 |
| (S)-3-(3,4-Dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl (E)-3-(3,4-dihydroxyphenyl)acrylate | 10970786 | Click to see | 374.30 | unknown | https://doi.org/10.1021/JF970520M |
| (S)-Rosmarinic acid | 639655 | Click to see | 360.30 | unknown |
https://doi.org/10.1021/JF970520M https://doi.org/10.1016/S0031-9422(00)83060-5 https://doi.org/10.1248/BPB.25.1197 https://doi.org/10.1271/BBB.60.1093 https://doi.org/10.1021/JF980557M https://doi.org/10.1055/S-2006-957510 https://doi.org/10.1055/S-2001-10878 |
| 2-(3,4-Dihydroxyphenyl)ethenyl 3-(3,4-dihydroxyphenyl)prop-2-enoate | 78384837 | Click to see C1=CC(=C(C=C1C=CC(=O)OC=CC2=CC(=C(C=C2)O)O)O)O | 314.29 | unknown | https://doi.org/10.1248/CPB.38.1772 |
| 2-(3,5-Dihydroxyphenyl)ethenyl 3-(3,4-dihydroxyphenyl)prop-2-enoate | 78384838 | Click to see C1=CC(=C(C=C1C=CC(=O)OC=CC2=CC(=CC(=C2)O)O)O)O | 314.29 | unknown | https://doi.org/10.1248/CPB.38.1772 |
| 3-(3,4-Dihydroxyphenyl) acrylic acid 1-(3,4-dihydroxyphenyl)-2-methoxycarbonylethyl ester | 73809375 | Click to see | 374.30 | unknown | https://doi.org/10.1271/BBB.60.732 |
| 3-(3,4-Dihydroxyphenyl)-2-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]propanoic acid | 5099 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 360.30 | unknown |
https://doi.org/10.1271/BBB.60.1093 https://doi.org/10.1055/S-2001-10878 https://doi.org/10.1016/S0031-9422(00)83060-5 https://doi.org/10.1248/BPB.25.1197 https://doi.org/10.1021/JF980557M https://doi.org/10.1021/JF970520M https://doi.org/10.1055/S-2006-957510 |
| 3-(3,4-Dihydroxyphenyl)-3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]propanoic acid | 77583661 | Click to see | 360.30 | unknown | https://doi.org/10.1271/BBB.60.732 |
| 3,4-Dihydroxycinnamic acid methyl ester | 92202 | Click to see | 194.18 | unknown |
https://doi.org/10.1055/S-2006-957510 https://doi.org/10.1271/BBB.60.1093 https://doi.org/10.1271/BBB.60.732 |
| Ethenyl 3-(3,4-dihydroxyphenyl)prop-2-enoate | 71435608 | Click to see | 206.19 | unknown | https://doi.org/10.1271/BBB.60.1093 |
| ethyl (3R)-3-(3,4-dihydroxyphenyl)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropanoate | 163188013 | Click to see | 388.40 | unknown | https://doi.org/10.1271/BBB.60.732 |
| Ethyl 3-(3,4-dihydroxyphenyl)-3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]propanoate | 162890361 | Click to see | 388.40 | unknown | https://doi.org/10.1271/BBB.60.732 |
| methyl (3R)-3-(3,4-dihydroxyphenyl)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropanoate | 163185604 | Click to see | 374.30 | unknown | https://doi.org/10.1271/BBB.60.732 |
| Methyl 3-(3,4-dihydroxyphenyl)-2-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]propanoate | 76511959 | Click to see | 374.30 | unknown | https://doi.org/10.1021/JF970520M |
| Methyl Caffeate | 689075 | Click to see | 194.18 | unknown |
https://doi.org/10.1271/BBB.60.732 https://doi.org/10.1271/BBB.60.1093 https://doi.org/10.1055/S-2006-957510 |
| Methyl cis-ferulate | 10176654 | Click to see COC1=C(C=CC(=C1)C=CC(=O)OC)O | 208.21 | unknown | via CMAUP database |
| Nepetoidin A | 5316820 | Click to see | 314.29 | unknown | https://doi.org/10.1248/CPB.38.1772 |
| Nepetoidin B | 5316819 | Click to see | 314.29 | unknown | https://doi.org/10.1248/CPB.38.1772 |
| Rosmarinate | 5315615 | Click to see C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 360.30 | unknown | via CMAUP database |
| Rosmarinic Acid | 5281792 | Click to see | 360.30 | unknown |
https://doi.org/10.1055/S-2001-10878 https://doi.org/10.1016/S0031-9422(00)83060-5 https://doi.org/10.1248/BPB.25.1197 https://doi.org/10.1271/BBB1961.53.1971 https://doi.org/10.1021/JF970520M https://doi.org/10.1002/PTR.1115 https://doi.org/10.1055/S-2006-957510 https://doi.org/10.1248/BPB.31.1376 |
| Rosmarinic Acid Methyl Ester | 3012090 | Click to see | 374.30 | unknown | https://doi.org/10.1021/JF970520M |
| Vinyl caffeate | 11127419 | Click to see C=COC(=O)C=CC1=CC(=C(C=C1)O)O | 206.19 | unknown | https://doi.org/10.1271/BBB.60.1093 |
| > Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids | |||||
| 3-(3,4-Dihydroxyphenyl)Prop-2-Enoic Acid | 2518 | Click to see | 180.16 | unknown |
https://doi.org/10.1055/S-2001-10878 https://doi.org/10.1016/S0031-9422(00)83060-5 https://doi.org/10.1271/BBB.60.1093 https://doi.org/10.1055/S-2006-957510 https://doi.org/10.1248/BPB.25.1197 https://doi.org/10.1271/BBB.60.732 |
| Caffeic Acid | 689043 | Click to see | 180.16 | unknown |
https://doi.org/10.1271/BBB.60.1093 https://doi.org/10.1055/S-2001-10878 https://doi.org/10.1055/S-2006-957510 https://doi.org/10.1016/S0031-9422(00)83060-5 https://doi.org/10.1248/BPB.25.1197 https://doi.org/10.1007/BF02491096 https://doi.org/10.1271/BBB.60.732 |
| cis-Caffeic acid | 1549111 | Click to see C1=CC(=C(C=C1C=CC(=O)O)O)O | 180.16 | unknown | via CMAUP database |
| Ferulic Acid | 445858 | Click to see | 194.18 | unknown | via CMAUP database |
| Sinapinic acid | 1549091 | Click to see | 224.21 | unknown | via CMAUP database |
| Sinapinic acid | 637775 | Click to see COC1=CC(=CC(=C1O)OC)C=CC(=O)O | 224.21 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 6,7-dihydroxycoumarins | |||||
| Esculetin | 5281416 | Click to see | 178.14 | unknown | https://doi.org/10.1271/BBB.60.1093 |
| > Phenylpropanoids and polyketides / Coumarins and derivatives / Pyranocoumarins / Linear pyranocoumarins | |||||
| Graveolone | 177751 | Click to see CC1(CC(=O)C2=C(O1)C=C3C(=C2)C=CC(=O)O3)C | 244.24 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins | |||||
| (+)-Epicatechin | 182232 | Click to see | 290.27 | unknown | via CMAUP database |
| 2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol | 1203 | Click to see | 290.27 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones | |||||
| (2R)-5,6,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one | 162988960 | Click to see C1C(OC2=C(C1=O)C(=C(C(=C2)O)O)O)C3=CC=C(C=C3)O | 288.25 | unknown | https://doi.org/10.1016/S0031-9422(00)83060-5 |
| 5,6,7-Trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one | 9879022 | Click to see | 288.25 | unknown | https://doi.org/10.1016/S0031-9422(00)83060-5 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavones | |||||
| 6,7,3',4'-Tetrahydroxyflavone | 24721539 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=CC(=C(C=C3O2)O)O)O)O | 286.24 | unknown | https://doi.org/10.1271/BBB.60.1093 |
| Apigenin | 5280443 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O | 270.24 | unknown |
https://doi.org/10.1016/S0963-9969(01)00083-7 https://doi.org/10.1080/00021369.1981.10864793 |
| Luteolin | 5280445 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O | 286.24 | unknown |
https://doi.org/10.1021/JF970520M https://doi.org/10.1080/00021369.1981.10864793 https://doi.org/10.1248/BPB.25.1197 https://doi.org/10.1016/S0963-9969(01)00083-7 |
| Scutellarein | 5281697 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C=C(C(=C3O)O)O)O | 286.24 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanidin 3-O-p-coumaroyl glycosides / Anthocyanidin 3-O-6-p-coumaroyl glycosides | |||||
| 3-[[(3S,4S,6S)-6-[2-(3,4-dihydroxyphenyl)-7-hydroxy-3-[(2S,5S)-3,4,5-trihydroxy-6-[3-(4-hydroxyphenyl)prop-2-enoyloxymethyl]oxan-2-yl]oxychromenylium-5-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid | 57090016 | Click to see C1=CC(=CC=C1C=CC(=O)OCC2C(C(C(C(O2)OC3=C([O+]=C4C=C(C=C(C4=C3)OC5C(C(C(C(O5)COC(=O)CC(=O)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O)O)O)O | 843.70 | unknown | via CMAUP database |
| CID 101586992 | 101586992 | Click to see C1=CC(=CC=C1C=CC(=O)OCC2C(C(C(C(O2)OC3=C([O+]=C4C=C(C=C(C4=C3)OC5C(C(C(C(O5)COC(=O)CC(=O)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O)O)O)O | 843.70 | unknown | via CMAUP database |
| Malonylshisonin | 11972402 | Click to see C1=CC(=CC=C1C=CC(=O)OCC2C(C(C(C(O2)OC3=C([O+]=C4C=C(C=C(C4=C3)OC5C(C(C(C(O5)COC(=O)CC(=O)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O)O)O)O | 843.70 | unknown |
https://doi.org/10.1271/BBB1961.54.1745 https://doi.org/10.1271/BBB1961.53.1971 |
| Shisonin | 5282068 | Click to see | 757.70 | unknown |
https://doi.org/10.1271/BBB1961.54.1745 https://doi.org/10.1271/BBB1961.53.1971 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanins / Anthocyanidin-5-O-glycosides | |||||
| Cyanin | 441688 | Click to see | 611.50 | unknown | https://doi.org/10.1271/BBB1961.54.1745 |
| > 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 | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-7-O-glucuronides | |||||
| 5,6-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 2-O-beta-D-glucopyranuronosyl-beta-D-glucopyranosiduronic acid | 102158504 | Click to see | 638.50 | unknown | via CMAUP database |
| Breviscapine | 6426802 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O)O | 462.40 | unknown | https://doi.org/10.1055/S-2001-10878 |
| Clerodendrin | 5488004 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)O)O | 622.50 | unknown | https://doi.org/10.1055/S-2001-10878 |
| Flavone base + 3O, O-HexA-HexA | 74977517 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)O)O | 622.50 | unknown | https://doi.org/10.1055/S-2001-10878 |
| Flavone base + 4O, O-HexA-HexA | 74413803 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)O)O)O | 638.50 | unknown |
https://doi.org/10.1055/S-2001-10878 https://doi.org/10.1248/BPB.25.1197 |
| Luteolin 7-diglucuronide | 5282153 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)O)O)O | 638.50 | unknown |
https://doi.org/10.1248/BPB.25.1197 https://doi.org/10.1007/S10600-006-0049-Y https://doi.org/10.1055/S-2001-10878 |
| Luteolin 7-glucuronide | 5280601 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O)O | 462.40 | unknown | https://doi.org/10.1248/BPB.25.1197 |
| Luteolin-7-o-beta-d-glucuronide methyl ester | 91129494 | Click to see | 476.40 | unknown | https://doi.org/10.1055/S-2006-957510 |
| Luteolin-7-O-glucuronide | 13607752 | Click to see | 462.40 | unknown | https://doi.org/10.1248/BPB.25.1197 |
| Methyl 6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate | 74977642 | Click to see | 476.40 | unknown | https://doi.org/10.1055/S-2006-957510 |
| Scutellarin | 185617 | Click to see | 462.40 | unknown |
https://doi.org/10.1016/S0031-9422(00)83060-5 https://doi.org/10.1055/S-2001-10878 https://doi.org/10.1248/BPB.24.1206 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides | |||||
| 2-(3,4-Dihydroxyphenyl)-7-hydroxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | 15559460 | Click to see | 448.40 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides | |||||
| (2S)-7-[[(2S,3R,3aS,6R,6aR)-3-[[(2S,3R,3aR,6R,6aR)-3,6-dihydroxy-5-oxo-3,3a,6,6a-tetrahydro-2H-furo[3,2-b]furan-2-yl]oxy]-6-hydroxy-5-oxo-3,3a,6,6a-tetrahydro-2H-furo[3,2-b]furan-2-yl]oxy]-2-(3,4-dihydroxyphenyl)-5-hydroxy-2,3-dihydrochromen-4-one | 163015735 | Click to see | 604.50 | unknown | https://doi.org/10.1016/S0031-9422(00)83060-5 |
| [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate | 21579296 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)COC(=O)C=CC5=CC(=C(C=C5)O)O)O)O)O)O)O | 594.50 | unknown | https://doi.org/10.1080/00021369.1981.10864793 |
| [3,4,5-Trihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methyl 3-(3,4-dihydroxyphenyl)prop-2-enoate | 73804009 | Click to see | 594.50 | unknown | https://doi.org/10.1080/00021369.1981.10864793 |
| 5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | 44257792 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O | 432.40 | unknown | via CMAUP database |
| 7-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxychromen-4-one | 14054265 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)OC5C(C(C(C(O5)CO)O)O)O)O)O)O)O)O | 610.50 | unknown | https://doi.org/10.1080/00021369.1981.10864793 |
| 7-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)chromen-4-one | 60195926 | Click to see | 594.50 | unknown | https://doi.org/10.1080/00021369.1981.10864793 |
| 7-[[3-[(3,6-dihydroxy-5-oxo-3,3a,6,6a-tetrahydro-2H-furo[3,2-b]furan-2-yl)oxy]-6-hydroxy-5-oxo-3,3a,6,6a-tetrahydro-2H-furo[3,2-b]furan-2-yl]oxy]-2-(3,4-dihydroxyphenyl)-5-hydroxy-2,3-dihydrochromen-4-one | 163015734 | Click to see | 604.50 | unknown | https://doi.org/10.1016/S0031-9422(00)83060-5 |
| 7-[3,4-Dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxychromen-4-one | 14054263 | Click to see | 610.50 | unknown | https://doi.org/10.1080/00021369.1981.10864793 |
| Apigenin 7-[galactosyl-(1->4)-mannoside] | 73840313 | Click to see | 594.50 | unknown | https://doi.org/10.1080/00021369.1981.10864793 |
| Apigenin 7-O-glucoside | 5280704 | Click to see | 432.40 | unknown |
https://doi.org/10.1080/00021369.1981.10864793 https://doi.org/10.1002/PCA.2521 |
| Apigenin-7-O-Glucoside | 12304093 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O | 432.40 | unknown | via CMAUP database |
| Luteolin 7-galactoside | 5291488 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O | 448.40 | unknown | https://doi.org/10.1080/00021369.1981.10864793 |
| Luteolin 7-O-glucoside | 5280637 | Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O | 448.40 | unknown |
https://doi.org/10.1080/00021369.1981.10864793 https://doi.org/10.1002/PCA.2521 |
| Npc85473 | 5385553 | Click to see | 432.40 | unknown | https://doi.org/10.1080/00021369.1981.10864793 |
| > Phenylpropanoids and polyketides / Flavonoids / Hydroxyflavonoids / 7-hydroxyflavonoids | |||||
| 2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-1-Benzopyrylium | 128861 | Click to see | 287.24 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 3-O-methylated flavonoids | |||||
| Chryseriol | 5280666 | Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O | 300.26 | unknown |
https://doi.org/10.1002/PCA.2521 https://doi.org/10.1021/JF970520M https://doi.org/10.1016/S0963-9969(01)00083-7 |
| > Phenylpropanoids and polyketides / Isoflavonoids / Isoflav-2-enes / Isoflavones | |||||
| Orobol | 5281801 | Click to see C1=CC(=C(C=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O)O | 286.24 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Isoflavonoids / Isoflavonoid O-glycosides | |||||
| 5-hydroxy-3-[4-hydroxy-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | 99653118 | Click to see C1=CC(=C(C=C1C2=COC3=CC(=CC(=C3C2=O)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O | 610.50 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Stilbenes / Stilbene glycosides | |||||
| 2-[2,4-Dihydroxy-6-[2-(4-hydroxyphenyl)ethenyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol | 76537225 | Click to see C1=CC(=CC=C1C=CC2=C(C(=CC(=C2)O)O)C3C(C(C(C(O3)CO)O)O)O)O | 390.40 | unknown | https://doi.org/10.1016/S0031-9422(00)90843-4 |
Collections Top
| In private collections | 0 |
| In public collections | 0 |