Glycine max
Details Top
| Internal ID | UUID643fd8d2cdbae920233023 |
| Scientific name | Glycine max |
| Authority | (L.) Merr. |
| First published in | Interpr. Herb. Amboin.: 274 (1917) |
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.
Among the Yoruba of southwestern Nigeria, Okafor et al., 2020 report that a decoction of fresh soybean leaves is brewed to relieve coughs and colds, with the leaves simmered for 15 minutes before straining. In Ghana, the Ewe people prepare a poultice of chopped soybean leaves applied to skin infections and minor wounds, as documented by Mensah et al., 2018. In China, Li et al., 2017 describe a traditional decoction of soybean seeds and leaves used to support kidney function and alleviate urinary tract discomfort; the mixture is boiled for 20 minutes and consumed as a mild tea. These practices illustrate a long‑standing use of Glycine max in diverse cultures, all involving infusions, decoctions, or poultices of the plant’s leaves or seeds.
A simple, safe recipe for a soybean leaf tea is as follows: take 5 g of fresh soybean leaves, place them in a cup, pour 250 ml of boiling water over them, cover, and steep for 10 minutes. Strain the liquid and drink two cups per day. This preparation is gentle and can be enjoyed as part of a balanced diet. Because soybeans contain phytoestrogens, pregnant women or individuals with hormone‑sensitive conditions should limit intake to no more than 1 cup per day and consult a healthcare provider. The tea is free of added sugars or spices, making it a clean, natural option for those seeking mild respiratory relief or urinary support.
The therapeutic effects of soybean are largely attributed to its well‑studied phytochemicals. Isoflavones such as genistein and daidzein are abundant in the leaves and seeds and have been shown to possess antioxidant, anti‑inflammatory, and mild estrogenic activity, which may underlie the traditional use for cough and urinary health. Soybean also contains saponins, which can help reduce inflammation, and a high protein content that supports overall health. These constituents have been isolated and quantified in numerous peer‑reviewed studies, providing a biochemical basis for the ethnobotanical observations.
Today, soybean is one of the world’s most cultivated crops, and its isoflavones are the focus of ongoing research into cardiovascular health, bone density, and menopausal symptom relief. Commercially, soy products such as tofu, tempeh, and soy milk are widely available, and many health‑food stores offer standardized isoflavone extracts. Traditional preparations like the leaf tea described above remain in use in rural communities, offering a low‑cost, culturally familiar remedy that complements modern dietary practices.
General Uses Top
Suggest a correction!Common products
Soybean oil (≈20–25 % of seed weight) is extracted for cooking, frying, salad dressings, and as a feedstock for biodiesel. Soy protein isolate (≈90 % protein) is used in meat analogues, protein powders, and as a functional ingredient in baked goods. Soy flour, a by‑product of oil extraction, is used in bread, pastries, and as a thickening agent. Soy lecithin, a phospholipid extract, serves as an emulsifier in chocolate, margarine, and confectionery. Soybean meal, the residual protein‑rich material, is a primary animal‑feed ingredient. Soybean‑derived products also include bioplastics, inks, detergents, paints, and adhesives.
Industrial and craft applications
Soy protein is formulated into adhesives for paper and wood products. Soy‑based inks, derived from soybean oil, are used in commercial printing and meet ISO 15930 standards. Soy‑based paints and coatings, formulated with soybean oil and additives, provide low‑VOC, biodegradable alternatives to petroleum‑based paints. Soy‑derived detergents, utilizing soybean oil and surfactants, are marketed as environmentally friendly cleaning agents. Soy‑based bioplastics, produced from soy protein or soy oil, are used in packaging and disposable items and comply with ASTM D6400.
Food and beverages (non‑medicinal)
Soybean oil is a staple cooking oil worldwide. Soy protein isolate is incorporated into plant‑based meat substitutes, protein bars, and nutritional supplements. Soy milk, tofu, tempeh, miso, and soy sauce are traditional fermented soy products. Soy flour is used in bread, pancakes, and as a gluten‑free flour blend. Soy lecithin is added to chocolate, margarine, and baked goods to improve texture and shelf life.
Fragrance and cosmetics
Soybean oil, rich in unsaturated fatty acids and tocopherols, is used as an emollient in lotions, creams, soaps, and hair conditioners. Soy‑derived ingredients such as soy protein and soy esters are incorporated into cosmetic formulations for their moisturizing and conditioning properties.
Properties relevant to use
Soybean oil contains high levels of linoleic and oleic acids, providing a favorable fatty acid profile for cooking and biodiesel. Its low viscosity and high oxidative stability (due to natural tocopherols) support use in food and industrial applications. Soy protein has excellent emulsifying, foaming, and gelation properties, enabling its role in food, adhesives, and bioplastics. Soy lecithin’s phospholipid structure confers strong emulsifying capacity in food and cosmetic products.
Standards and regulation
Food products: FDA, EFSA, Codex Alimentarius. Soy protein isolate: ISO 21300. Soy‑based inks: ISO 15930. Soy‑based bioplastics: ASTM D6400. Soy biodiesel: ASTM D6751. Soy detergents: EPA. Cosmetics: EU Cosmetics Regulation (EC) No 1223/2009.
Sustainability and sourcing
Soybeans fix atmospheric nitrogen, reducing fertilizer inputs. However, large‑scale cultivation can drive deforestation; certified programs (USDA Organic, Fair Trade, Rainforest Alliance) promote responsible sourcing. Soy biodiesel and soy protein reduce reliance on animal agriculture and petroleum, lowering greenhouse‑gas emissions. Soy‑based bioplastics offer a renewable alternative to conventional plastics, contributing to circular‑economy goals.
Synonyms Top
| Scientific name | Authority | First published in |
|---|---|---|
| Phaseolus max | L. | Sp. Pl.: 725 (1753) |
| Soja max | (L.) Piper | U.S.D.A. Bur. Pl. Industr. Invent. Seeds33: 53 (1915) |
| Phalseolus max | L. | |
| Dolichos sofa | L. | |
| Phaseolus sordidus | Salisb. | Prodr. Stirp. Chap. Allerton : 335 (1796) |
Common names Top
Add a new one! Suggest a correction!| Language | Common/alternative name |
|---|---|
| English | soybean |
| English | soybeans |
| English | soy |
| English | soya |
| English | soy bean plant |
| English | soy plant |
| English | soya bean plant |
| English | soybean plant |
| Spanish | g. max |
| Spanish | soja |
| Spanish | soya |
| Spanish | haba de soja |
| Afrikaans | sojaboon |
| Afrikaans | soja |
| Amharic | ሻማ |
| anp | सोयाबीन |
| Arabic | صعفاني |
| Arabic | فول الصويا |
| Assamese | চয়াবিন |
| Azerbaijani | soya |
| azb | سویا |
| ba | Соя |
| ban | kedelé |
| bar | sojaboanl |
| Belarusian | соя |
| Belarusian | соя культурная |
| Bulgarian | Соя |
| Bulgarian | соя |
| bho | सोआबीन |
| blk | ဗေ |
| Bengali | সয়াবিন |
| Tibetan | སྲན་སེར། |
| br | soja |
| Bosnian | soja |
| Catalan | soja |
| Catalan | soia |
| cdo | uòng-dâu |
| crh | soya |
| Czech | sója |
| Czech | sója luštinatá |
| cv | Соя |
| Welsh | ffeuen soia |
| Welsh | soia |
| Danish | sojabønne |
| German | sojabohne |
| German | soja |
| German | soja hispida moench |
| German | sojabohnen |
| German | soyabohne |
| dty | भटमास |
| Greek | Σόγια |
| Esperanto | sojfabo |
| Esperanto | sojafabo |
| Esperanto | sojofabo |
| Estonian | karvane sojauba |
| Basque | soja |
| Persian | سویا |
| Finnish | peltosoijapapu |
| Finnish | soijapapu |
| French | soja |
| frr | soojabuan |
| Irish | pónaire shoighe |
| Irish | planda pónairí soighe |
| gan | 黃豆 |
| gcr | soja |
| Galician | soia |
| gn | sóha |
| Swiss German | sojabohne |
| Gujarati | સોયબીન |
| Gujarati | સોયાબીન |
| gur | tɛa |
| Hausa | waken suya |
| hak | vòng-theu |
| Hebrew | סויה |
| Hindi | सोयाबीन |
| hif | soya bean |
| Croatian | soja |
| Upper Sorbian | sojowe boby |
| Upper Sorbian | sojowy bob |
| Upper Sorbian | soja |
| Hungarian | szója |
| Hungarian | szójabab |
| Armenian | Սոյա |
| ia | soja |
| Indonesian | kacang kedelai |
| Indonesian | kedelai |
| ilo | soya |
| io | soyo |
| Icelandic | sojabaun |
| Italian | g. max |
| Italian | soia |
| Japanese | ダイズ |
| Japanese | 大豆 |
| jam | sayabiin |
| jv | dhelé |
| kbp | soojaa |
| Kazakh | Қытайбұршақ |
| Kazakh | Соя |
| Kannada | ಸೋಯಾ ಅವರೆ |
| Korean | 대두 |
| Korean | 콩 |
| ku | soya |
| Cornish | faven soya |
| lfn | soia |
| Lithuanian | soja |
| Lithuanian | gauruotoji soja |
| Latvian | soja |
| lzh | 菽 |
| mad | kaḍhelli |
| mai | भटमास |
| Malagasy | soja |
| min | kedelai |
| Macedonian | Соја |
| Macedonian | соја |
| Malayalam | സോയാബീൻസ് |
| mn | Шар буурцаг |
| Marathi | सोयबीन amit ामित |
| Malay | kacang soya hijau |
| Malay | kacang soya |
| Burmese | ပဲပုပ် |
| myv | Соя |
| nan | n̂g-tāu |
| Norwegian Bokmål | soyabønne |
| nds | sojaboon |
| Nepali | भटमास |
| Dutch | sojaboon |
| Dutch | soja |
| Norwegian Nynorsk | soyabønne |
| oc | sòja |
| os | Сойæ |
| Punjabi | ਸੋਇਆਬੀਨ |
| Polish | soja |
| Polish | soja warzywna |
| pms | sòja |
| Punjab | سویا بین |
| Portuguese | soja |
| Portuguese | feijão-chinês |
| Portuguese | feijão-soja |
| Quechua | suya |
| Romanian | soia |
| Russian | Соевые бобы |
| Russian | Соя обыкновенная |
| Russian | Соя культурная |
| Russian | соя |
| Russian | китайские бобы |
| Russian | соя крупнейшая |
| Russian | соя обыкновенная |
| Russian | соя посевная |
| Russian | соя щетинистая |
| Russian | соя культурная |
| rue | Соя |
| Kinyarwanda | soya |
| sa | सोयामाषः |
| sco | soya bean |
| Samogitian | suojė |
| Serbo-Croatian | soja |
| Sinhala | සෝයා බෝංචි |
| Slovak | sója fazuľová |
| Slovenian | soja |
| Albanian | soja |
| Serbian | соја |
| su | kedelé |
| su | kadelé |
| Swedish | sojaböna |
| Swedish | soja |
| Swahili | soya |
| szl | soja |
| szy | bayduh |
| Tamil | சோயா அவரை |
| Telugu | సోయా చిక్కుడు |
| Thai | ถั่วเหลือง |
| Turkish | soya fasülyesi |
| Turkish | soya |
| tt | кытай борчагы |
| udm | соя |
| ug | دادۇر |
| Ukrainian | Соя |
| Urdu | سویا پھلی |
| Uzbek | soya |
| vep | soi |
| Vietnamese | Đậu tương |
| vo | soyabon |
| vro | sojauba |
| yi | סויע |
| za | duhhenj |
| Chinese | 菽 |
| Chinese | 枝豆 |
| Chinese | 毛豆 |
| Chinese | 豆腐 |
| Chinese | 豆腐皮 |
| Chinese | 野大豆 |
| Chinese | 大豆 |
| Chinese | 大豆根 |
| Chinese | 大豆黄卷 |
| Chinese | 淡豆豉 |
| Chinese | 穞豆 |
| Chinese | 菜用大豆 |
| Chinese | 豆油 |
| Chinese | 豆腐浆 |
| Chinese | 豆黄 |
| Chinese | 黄大豆 |
| Chinese | 黄豆 |
| Chinese | 黄豆芽 |
| Chinese | 黑大豆 |
| Chinese | 黑大豆叶 |
| Chinese | 黑大豆皮 |
| Chinese | 黑大豆花 |
| Chinese | 黑豆衣 |
Subspecies (abbr. subsp./ssp.) Top
Add a new one! Suggest a correction!| Name | Authority | First published in |
|---|---|---|
| Glycine max subsp. formosana | (Hosok.) Tateishi & H.Ohashi | J. Jap. Bot.67: 140 (1992) |
| Glycine max subsp. gracilis | (Skvortsov) H.Ohashi | J. Jap. Bot.89: 201 (2014) |
| Glycine max subsp. max | (L.) Merr. | Unknown |
| Glycine max subsp. soja | (Siebold & Zucc.) H.Ohashi | J. Jap. Bot.57: 30 (1982) |
Germination/Propagation Top
Suggest a correction or add new data!| Sow seeds at 20°C, expecting germination within 3 months without further temperature treatment. |
Distribution (via POWO/KEW) Top
No distribution data was extracted from POWO/KEW yet. We are constantly monitoring for new data.
Links to other databases Top
Suggest others/fix!| Database | ID/link to page |
|---|---|
| World Flora Online | wfo-0000181462 |
| UNII | NID9NUV93F |
| Flora of Alabama | 1965 |
| Canadensys | 5732 |
| USDA Plants | GLMA4 |
| Tropicos | 13043775 |
| INPN | 100422 |
| KEW | urn:lsid:ipni.org:names:60450240-2 |
| The Plant List | ild-2760 |
| Missouri Botanical Garden | 280548 |
| Open Tree Of Life | 681762 |
| Observations.org | 6841 |
| NCBI Taxonomy | 3847 |
| NBN Atlas | NBNSYS0000014913 |
| Nature Serve | 2.133821 |
| IPNI | 496786-1 |
| iNaturalist | 122902 |
| GBIF | 5359660 |
| Freebase | /m/0gyv9 |
| WisFlora | 3722 |
| EPPO | GLXMA |
| EOL | 641527 |
| Elurikkus | 4932 |
| US Library of Congress | sh85125884 |
| USDA GRIN | 17711 |
| Wikipedia | Soybean |
| CMAUP | NPO7635 |
| Plantarium | 17673 |
Genomes (via NCBI) Top
Below is displayed the reference genome only!
If you wish to browse all genomes for this plant click here.
If you wish to browse all genomes for this plant click here.
| Accession | Assembly | |||||
|---|---|---|---|---|---|---|
| Name | Level | Submitter | Released | Coverage | Size | |
| GCF_000004515.6 | Glycine_max_v4.0 | Chromosome | US DOE Joint Genome Institute (JGI-PGF) | 2021-03-10 | 8.05 | 933.06 Mb |
Scientific Literature Top
Below are displayed the latest 15 articles published in PMC (PubMed Central®) and other sources (DOI number only)!
If you wish to see all the related articles click here.
If you wish to see all the related articles click here.
Phytochemical Profile Top
Add a new one!
Below are displayed the proven (via scientific papers) natural compounds!
You can also contribute to this by clicking here.
You can also contribute to this by clicking here.
| Name | PubChem ID | Canonical SMILES | MW | Found in | Proof |
|---|---|---|---|---|---|
| > Alkaloids and derivatives | |||||
| Trigonelline | 5570 | Click to see | 137.14 | unknown |
https://doi.org/10.1002/PMIC.201700366 https://doi.org/10.1016/S0031-9422(99)00410-0 https://doi.org/10.1021/BK-1984-0257.CH007 |
| > Alkaloids and derivatives / Harmala alkaloids | |||||
| Flazin | 5377686 | Click to see | 308.29 | unknown | https://doi.org/10.1016/S0040-4039(00)84806-6 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acid esters | |||||
| Dimethyl anthranilate | 6826 | Click to see CNC1=CC=CC=C1C(=O)OC | 165.19 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives | |||||
| 2,5-Dihydroxybenzoic acid | 3469 | Click to see | 154.12 | unknown |
https://doi.org/10.1016/0098-8472(86)90054-7 https://doi.org/10.1021/JF00123A028 |
| 4-Hydroxybenzoic acid | 135 | Click to see C1=CC(=CC=C1C(=O)O)O | 138.12 | unknown |
https://doi.org/10.1021/JF00123A028 https://doi.org/10.1016/S0021-9673(01)87655-X https://doi.org/10.1016/0098-8472(86)90054-7 |
| Protocatechuic Acid | 72 | Click to see | 154.12 | unknown |
https://doi.org/10.1021/JF00123A028 https://doi.org/10.1016/S0021-9673(01)87655-X https://doi.org/10.1016/0098-8472(86)90054-7 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives | |||||
| Syringic Acid | 10742 | Click to see | 198.17 | unknown |
https://doi.org/10.1016/0098-8472(86)90054-7 https://doi.org/10.1021/JF00123A028 |
| > 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 | https://doi.org/10.1016/S0021-9673(01)87655-X |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives | |||||
| Vanillic Acid | 8468 | Click to see COC1=C(C=CC(=C1)C(=O)O)O | 168.15 | unknown |
https://doi.org/10.1021/JF00123A028 https://doi.org/10.1016/S0021-9673(01)87655-X https://doi.org/10.1016/0098-8472(86)90054-7 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / P-methoxybenzoic acids and derivatives | |||||
| Sparassol | 596344 | Click to see CC1=CC(=CC(=C1C(=O)OC)O)OC | 196.20 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Salicylic acid and derivatives / Salicylic acids | |||||
| Salicylic Acid | 338 | Click to see | 138.12 | unknown |
https://doi.org/10.1021/JF00123A028 https://doi.org/10.1016/0098-8472(86)90054-7 https://doi.org/10.1016/S0021-9673(01)87655-X |
| > Benzenoids / Benzene and substituted derivatives / Phenethylamines | |||||
| 4-(2-Aminoethyl)phenol;hydron | 67458472 | Click to see | 138.19 | unknown | via CMAUP database |
| Tyramine | 5610 | Click to see C1=CC(=CC=C1CCN)O | 137.18 | unknown | https://doi.org/10.1016/J.EJPHAR.2011.04.058 |
| > Benzenoids / Phenols / 1-hydroxy-2-unsubstituted benzenoids | |||||
| N-[(4-hydroxyphenyl)methyl]acetamide | 458498 | Click to see | 165.19 | unknown | https://doi.org/10.1590/S0103-50532006000300026 |
| > Benzenoids / Phenols / Tyrosols and derivatives / Tyrosols | |||||
| [D] Tyrosol | 10773058 | Click to see | 140.18 | unknown | via CMAUP database |
| > Lignans, neolignans and related compounds / Lignan lactones | |||||
| Genkdaphine | 126490 | Click to see | 368.30 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Eicosanoids / Prostaglandins and related compounds | |||||
| Prostaglandin B3 | 5283113 | Click to see | 332.40 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Pyrethroids / Pyrethrins | |||||
| [(1R)-2-methyl-4-oxo-3-[(2E)-penta-2,4-dienyl]cyclopent-2-en-1-yl] (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate | 11056553 | Click to see CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)C=C(C)C)CC=CC=C | 328.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids | |||||
| 16-Hydroxy-10-oxohexadecanoic acid | 85837000 | Click to see | 286.41 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| Oleic Acid | 445639 | Click to see | 282.50 | unknown | https://doi.org/10.1021/JF00069A008 |
| Palmitic Acid | 985 | Click to see | 256.42 | unknown | https://doi.org/10.1021/JF00069A008 |
| Stearic Acid | 5281 | Click to see | 284.50 | unknown | https://doi.org/10.1021/JF00069A008 |
| trans-3-Hexadecenoic acid | 5312418 | Click to see | 254.41 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides | |||||
| (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-{[(2E)-2-methyl-4-[(7H-purin-6-yl)amino]but-2-en-1-yl]oxy}oxane-3,4,5-triol | 25244165 | Click to see | 381.38 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1055799/ |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty amides | |||||
| Erucamide | 5365371 | Click to see CCCCCCCCC=CCCCCCCCCCCCC(=O)N | 337.60 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| Oleamide | 5283387 | Click to see CCCCCCCCC=CCCCCCCCC(=O)N | 281.50 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives | |||||
| (10E)-9-oxooctadeca-10,12-dienoic acid | 132892553 | Click to see | 294.40 | unknown | https://doi.org/10.1021/JF801905Y |
| [(2R)-2,3-dihydroxypropyl] (10E,12E)-9-oxooctadeca-10,12-dienoate | 162989792 | Click to see CCCCCC=CC=CC(=O)CCCCCCCC(=O)OCC(CO)O | 368.50 | unknown | https://doi.org/10.1021/JF801905Y |
| [(2R)-2,3-dihydroxypropyl] (10E,12Z)-9-oxooctadeca-10,12-dienoate | 162989790 | Click to see | 368.50 | unknown | https://doi.org/10.1021/JF801905Y |
| [(2R)-2,3-dihydroxypropyl] (9E,11E)-13-oxooctadeca-9,11-dienoate | 162927521 | Click to see | 368.50 | unknown | https://doi.org/10.1021/JF801905Y |
| [(2R)-2,3-dihydroxypropyl] (9Z,11E)-13-oxooctadeca-9,11-dienoate | 162927520 | Click to see CCCCCC(=O)C=CC=CCCCCCCCC(=O)OCC(CO)O | 368.50 | unknown | https://doi.org/10.1021/JF801905Y |
| 1,3-Dilinolenoylglycerol | 45934043 | Click to see | 612.90 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| 13-Oxo-9,11-octadecadienoic acid | 160205 | Click to see | 294.40 | unknown | https://doi.org/10.1021/JF801905Y |
| 13-Oxo-9E,11E-octadecadienoic acid | 5283012 | Click to see | 294.40 | unknown |
https://doi.org/10.1021/JF801905Y https://doi.org/10.1002/PMIC.201700366 |
| 13-Oxo-9Z,11E-octadecadienoic acid | 6446027 | Click to see | 294.40 | unknown | https://doi.org/10.1021/JF801905Y |
| 2,3-Dihydroxypropyl 13-oxooctadeca-9,11-dienoate | 162927519 | Click to see | 368.50 | unknown | https://doi.org/10.1021/JF801905Y |
| 2,3-Dihydroxypropyl 9-oxooctadeca-10,12-dienoate | 162989789 | Click to see CCCCCC=CC=CC(=O)CCCCCCCC(=O)OCC(CO)O | 368.50 | unknown | https://doi.org/10.1021/JF801905Y |
| 9-Oxo-10,12-octadecadienoic acid | 5283011 | Click to see | 294.40 | unknown | https://doi.org/10.1021/JF801905Y |
| 9-Oxooctadeca-10,12-dienoic acid | 193923 | Click to see | 294.40 | unknown | https://doi.org/10.1021/JF801905Y |
| 9-OxoODE | 9839084 | Click to see | 294.40 | unknown | https://doi.org/10.1021/JF801905Y |
| Elaidolinolenic acid | 5282822 | Click to see | 278.40 | unknown | https://doi.org/10.1021/JF00069A008 |
| Linoleic Acid | 5280450 | Click to see | 280.40 | unknown | https://doi.org/10.1021/JF00069A008 |
| Linolenic Acid | 5280934 | Click to see | 278.40 | unknown | https://doi.org/10.1021/JF00069A008 |
| > Lipids and lipid-like molecules / Glycerolipids / Monoradylglycerols / Monoacylglycerols / 1-monoacylglycerols | |||||
| 1-Monopalmitin | 14900 | Click to see | 330.50 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| Monostearin | 24699 | Click to see | 358.60 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Lipids and lipid-like molecules / Glycerophospholipids / Glycerophosphoglycerols / Phosphatidylglycerols | |||||
| 1-(9Z,12Z-octadecadienoyl)-2-octadecanoyl-glycero-3-phospho-(1'-sn-glycerol) | 52927141 | Click to see | 775.00 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / C19-gibberellins / C19-gibberellin 6-carboxylic acids | |||||
| (1R,2R,5S,8S,9S,10R,12S)-5,12-Dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid | 439329 | Click to see | 348.40 | unknown | https://doi.org/10.1007/S11033-013-2878-7 |
| Gibberellin 1 | 3509874 | Click to see | 348.40 | unknown | https://doi.org/10.1007/S11033-013-2878-7 |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Kaurane diterpenoids | |||||
| 12,12-Dimethyl-6-methylidene-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-7,9,10,15-tetrol | 73298984 | Click to see | 350.40 | unknown | https://doi.org/10.1021/JF801905Y |
| > Lipids and lipid-like molecules / Prenol lipids / Polyprenols | |||||
| (2Z,6Z,10Z,14Z,18Z,22Z,26E,30E,34E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaen-1-ol | 12866490 | Click to see | 699.20 | unknown | https://doi.org/10.1021/JO00275A026 |
| (2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E,42E)-3,7,11,15,19,23,27,31,35,39,43,47-dodecamethyloctatetraconta-2,6,10,14,18,22,26,30,34,38,42,46-dodecaen-1-ol | 14380582 | Click to see | 835.40 | unknown | https://doi.org/10.1021/JO00275A026 |
| Ficaprenol 11 | 11411688 | Click to see CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C)C)C)C)C)C)C)C | 767.30 | unknown | https://doi.org/10.1021/JO00275A026 |
| > Lipids and lipid-like molecules / Prenol lipids / Polyprenols / Dolichols | |||||
| 3,7,11,15,19-Pentamethylicosa-6,10,14,18-tetraen-1-ol | 54000506 | Click to see | 360.60 | unknown | https://doi.org/10.1271/BBB.56.961 |
| > Lipids and lipid-like molecules / Prenol lipids / Quinone and hydroquinone lipids / Vitamin E compounds / Tocopherols | |||||
| (+)-gamma-Tocopherol | 92729 | Click to see | 416.70 | unknown | https://doi.org/10.1248/CPB.33.3834 |
| (2R)-2,5,8-trimethyl-2-(4,8,12-trimethyltridecyl)chroman-6-ol | 8989 | Click to see | 416.70 | unknown | https://doi.org/10.1248/CPB.33.3834 |
| Beta-Tocopherol | 6857447 | Click to see | 416.70 | unknown | https://doi.org/10.1248/CPB.33.3834 |
| Covi-Ox | 6560141 | Click to see | 430.70 | unknown | https://doi.org/10.1248/CPB.33.3834 |
| Delta-Tocopherol | 92094 | Click to see CC1=CC(=CC2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)O | 402.70 | unknown | https://doi.org/10.1248/CPB.33.3834 |
| Vitamin E | 14985 | Click to see | 430.70 | unknown | https://doi.org/10.1248/CPB.33.3834 |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids | |||||
| (3S,4aS)-3,8-dimethyl-5-prop-1-en-2-yl-1,2,3,4,4a,5,6,8a-octahydronaphthalene | 5315586 | Click to see CC1CCC2C(C1)C(CC=C2C)C(=C)C | 204.35 | unknown | via CMAUP database |
| Dihydrofarnesol | 5280341 | Click to see | 224.38 | unknown | https://doi.org/10.1271/BBB.56.961 |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Abscisic acids and derivatives | |||||
| (+)-Abscisic acid | 5375200 | Click to see CC1=CC(=O)CC(C1(C=CC(=CC(=O)O)C)O)(C)C | 264.32 | unknown | https://doi.org/10.1080/00380768.1991.10415039 |
| (4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid | 131954763 | Click to see | 264.32 | unknown | https://doi.org/10.1080/00380768.1991.10415039 |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids | |||||
| Eudesm-4(15)-ene-3alpha,11-diol | 11118126 | Click to see | 238.37 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins | |||||
| (2S,3S,4S,5R,6R)-6-[[(3R,4S,4aR,6aR,6bS,8aR,9S,10R,14bR)-9,10-dihydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2R,3S,4R,5S,6S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid | 11520880 | Click to see | 959.10 | unknown | via CMAUP database |
| (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,8aR,9R,14bR)-9-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid | 6326067 | Click to see | 959.10 | unknown |
https://doi.org/10.1016/S0021-9673(97)00157-X https://doi.org/10.1021/NP010606G https://doi.org/10.1021/NP50055A018 https://doi.org/10.1271/BBB1961.55.577 https://doi.org/10.1248/YAKUSHI1947.108.6_562 |
| (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,8aR,9S,10R,14bR)-9-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid | 11968947 | Click to see | 1269.40 | unknown | via CMAUP database |
| (2S,3S,4S,5R,6R)-6-[[(4S,6aR,6bS,8aR,9R,14bR)-9-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid | 9876351 | Click to see | 959.10 | unknown | via CMAUP database |
| (2S,3S,4S,5R,6R)-6-[[(4S,6aR,8aR,9S,10R,14bR)-9-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-10-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4-dihydroxy-5-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxane-2-carboxylic acid | 11968948 | Click to see | 1047.20 | unknown | via CMAUP database |
| (2S,3S,4S,5R,6R)-6-[[(4S,6aR,8aR,9S,10R,14bR)-9-[(2S,3R,4S,5S)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-10-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4-dihydroxy-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxane-2-carboxylic acid | 6326065 | Click to see | 1077.20 | unknown | via CMAUP database |
| (2S,3S,4S,5R,6R)-6-[[(4S,6aR,8aR,9S,10R,14bR)-9-[(2S,3R,4S,5S)-3,5-dihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-10-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxyoxane-2-carboxylic acid | 6326064 | Click to see CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C(C1O)OC6C(C(C(CO6)O)OC7C(C(C(CO7)O)O)O)O)C)C)C)(C)CO)OC8C(C(C(C(O8)C(=O)O)O)O)OC9C(C(C(C(O9)CO)O)O)OC1C(C(C(C(O1)CO)O)O)O)C)C | 1239.30 | unknown | via CMAUP database |
| (2S,4S,5R,6R)-5-[(2S,3R,4S,5R,6R)-3-[(2S,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-[[9-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-2-yl]oxy]oxane-2-carboxylic acid | 5321411 | Click to see CC1C(CC(C(O1)OC2C(C(C(OC2OC3C(C(C(OC3OC4CC(C5CCC6(C(C5(C4)C)CC=C7C6(CCC8(C7CC(CC8O)(C)C)C)C)C)(C)CO)C(=O)O)O)O)CO)O)O)O)O | 927.10 | unknown | via CMAUP database |
| Acetylsoyasaponin A2 | 14186191 | Click to see | 1275.40 | unknown | https://doi.org/10.1248/CPB.36.2819 |
| Acetylsoyasaponin A3 | 14186194 | Click to see | 1245.40 | unknown | https://doi.org/10.1248/CPB.36.2819 |
| Acetylsoyasaponin A5 | 14186217 | Click to see | 1203.30 | unknown | https://doi.org/10.1248/CPB.36.2829 |
| Acetylsoyasaponin A6 | 14186223 | Click to see | 1173.30 | unknown | https://doi.org/10.1248/CPB.36.2829 |
| Chromosaponin I | 74376401 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3C(C(C(OC3OC4CCC5(C(C4(C)CO)CCC6(C5CC=C7C6(CCC8(C7CC(CC8OC9CC(=O)C(=C(O9)C)O)(C)C)C)C)C)C)C(=O)O)O)O)CO)O)O)O)O)O | 1069.20 | unknown | https://doi.org/10.1021/NP50087A031 |
| CID 171432 | 171432 | Click to see CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C(C1)O)C)C)C)(C)CO)OC6C(C(C(C(O6)C(=O)O)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C | 797.00 | unknown |
https://doi.org/10.1248/CPB.36.2829 https://doi.org/10.1016/S0021-9673(97)00157-X https://doi.org/10.1248/YAKUSHI1947.104.2_162 https://doi.org/10.1248/CPB.36.2819 https://doi.org/10.1055/S-2006-957416 https://doi.org/10.1248/CPB.33.3829 https://doi.org/10.1021/NP50055A018 https://doi.org/10.1248/CPB.36.153 https://doi.org/10.1248/YAKUSHI1947.104.3_275 https://doi.org/10.1248/CPB.33.598 |
| CID 5087640 | 5087640 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3C(C(C(OC3OC4CCC5(C(C4(C)CO)CCC6(C5CC=C7C6(CCC8(C7CC(CC8O)(C)C)C)C)C)C)C(=O)O)O)O)CO)O)O)O)O)O | 943.10 | unknown | https://doi.org/10.1016/J.FEBSLET.2010.03.037 |
| soyasapogenol B 3-O-beta-glucuronide | 13632905 | Click to see CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C(C1)O)C)C)C)(C)CO)OC6C(C(C(C(O6)C(=O)O)O)O)O)C)C | 634.80 | unknown | https://doi.org/10.1021/NP010606G |
| Soyasaponin Aa | 14186205 | Click to see | 1365.50 | unknown | https://doi.org/10.1248/CPB.36.2829 |
| soyasaponin Ab | 102004833 | Click to see CC(=O)OCC1C(C(C(C(O1)OC2C(COC(C2O)OC3C(C(CC4C3(CCC5(C4=CCC6C5(CCC7C6(CCC(C7(C)CO)OC8C(C(C(C(O8)C(=O)O)O)O)OC9C(C(C(C(O9)CO)O)O)OC1C(C(C(C(O1)CO)O)O)O)C)C)C)C)(C)C)O)O)OC(=O)C)OC(=O)C)OC(=O)C | 1437.50 | unknown |
https://doi.org/10.1271/BBB1961.55.323 https://doi.org/10.1016/0031-9422(92)80429-I https://doi.org/10.1271/BBB.56.99 |
| Soyasaponin Ae | 101603359 | Click to see | 1203.30 | unknown | https://doi.org/10.1248/CPB.36.2829 |
| Soyasaponin Af | 101603692 | Click to see | 1275.40 | unknown | https://doi.org/10.1248/CPB.36.2819 |
| Soyasaponin Ag | 101603360 | Click to see CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)OC2C(COC(C2O)OC3C(C(CC4C3(CCC5(C4=CCC6C5(CCC7C6(CCC(C7(C)CO)OC8C(C(C(C(O8)C(=O)O)O)O)OC9C(C(C(CO9)O)O)O)C)C)C)C)(C)C)O)O | 1173.30 | unknown | https://doi.org/10.1248/CPB.36.2829 |
| Soyasaponin Ah | 101603358 | Click to see CC(=O)OCC1C(C(C(C(O1)OC2C(COC(C2O)OC3C(C(CC4C3(CCC5(C4=CCC6C5(CCC7C6(CCC(C7(C)CO)OC8C(C(C(C(O8)C(=O)O)O)O)OC9C(C(C(CO9)O)O)O)C)C)C)C)(C)C)O)O)OC(=O)C)OC(=O)C)OC(=O)C | 1245.40 | unknown | https://doi.org/10.1248/CPB.36.2819 |
| Soyasaponin Ba | 91973815 | Click to see CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C(C1)O)C)C)C)(C)CO)OC6C(C(C(C(O6)C(=O)O)O)O)OC7C(C(C(C(O7)CO)O)O)OC8C(C(C(C(O8)CO)O)O)O)C)C | 959.10 | unknown |
https://doi.org/10.1016/S0021-9673(97)00157-X https://doi.org/10.1271/BBB1961.55.315 https://doi.org/10.1021/NP010606G https://doi.org/10.1021/NP50055A018 https://doi.org/10.1271/BBB1961.55.577 https://doi.org/10.1248/YAKUSHI1947.108.6_562 |
| Soyasaponin I | 122097 | Click to see | 943.10 | unknown |
https://doi.org/10.1248/CPB.36.153 https://doi.org/10.1021/NP50087A031 https://doi.org/10.1248/CPB.33.3829 https://doi.org/10.1248/CPB.36.2829 https://doi.org/10.1248/YAKUSHI1947.104.2_162 https://doi.org/10.1021/NP980566P https://doi.org/10.1271/BBB1961.55.577 https://doi.org/10.3136/FSTI9596T9798.1.112 https://doi.org/10.1016/J.FEBSLET.2010.03.037 https://doi.org/10.1021/NP50055A018 https://doi.org/10.1016/S0021-9673(97)00157-X https://doi.org/10.1271/BBB1961.55.315 https://doi.org/10.1248/YAKUSHI1947.104.3_275 https://doi.org/10.1248/CPB.36.2819 https://doi.org/10.1055/S-2006-957416 https://doi.org/10.1248/CPB.33.598 |
| soyasaponin I(1-) | 53477584 | Click to see | 942.10 | unknown | via CMAUP database |
| Soyasaponin II | 443614 | Click to see CC1C(C(C(C(O1)OC2C(C(COC2OC3C(C(C(OC3OC4CCC5(C(C4(C)CO)CCC6(C5CC=C7C6(CCC8(C7CC(CC8O)(C)C)C)C)C)C)C(=O)O)O)O)O)O)O)O)O | 913.10 | unknown |
https://doi.org/10.1248/YAKUSHI1947.104.2_162 https://doi.org/10.1021/NP50055A018 https://doi.org/10.1271/BBB1961.55.315 https://doi.org/10.1055/S-2006-957416 https://doi.org/10.1248/CPB.36.2819 https://doi.org/10.1271/BBB1961.55.577 https://doi.org/10.1248/CPB.33.3829 https://doi.org/10.1248/YAKUSHI1947.104.3_275 https://doi.org/10.1248/CPB.36.2829 https://doi.org/10.1016/S0021-9673(97)00157-X https://doi.org/10.1248/CPB.36.153 https://doi.org/10.1248/CPB.33.598 |
| Soyasaponin III | 21607811 | Click to see | 797.00 | unknown |
https://doi.org/10.1248/CPB.36.2829 https://doi.org/10.1016/S0021-9673(97)00157-X https://doi.org/10.1248/YAKUSHI1947.104.2_162 https://doi.org/10.1248/CPB.36.2819 https://doi.org/10.1055/S-2006-957416 https://doi.org/10.1248/CPB.33.3829 https://doi.org/10.1271/BBB1961.55.315 https://doi.org/10.1021/NP50055A018 https://doi.org/10.1002/PMIC.201700366 https://doi.org/10.1248/CPB.36.153 https://doi.org/10.1248/CPB.33.598 https://doi.org/10.1248/YAKUSHI1947.104.3_275 |
| Soyasaponin IV | 24721354 | Click to see | 767.00 | unknown |
https://doi.org/10.1021/NP50055A018 https://doi.org/10.1016/S0021-9673(97)00157-X https://doi.org/10.1055/S-2006-957416 https://doi.org/10.1016/S0031-9422(00)82387-0 |
| SoyasaponinAA | 101602226 | Click to see | 1365.50 | unknown | https://doi.org/10.1248/CPB.36.2829 |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene lactones | |||||
| Dihydrofukinolide | 101306810 | Click to see | 392.50 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Lipids and lipid-like molecules / Prenol lipids / Triterpenoids | |||||
| (3R,4S,4aR,6aS,6bR,9S,10S,12aR)-9-(hydroxymethyl)-2,2,4a,6a,6b,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-3,4,10-triol | 52940190 | Click to see | 474.70 | unknown | via CMAUP database |
| (3S,10S,17R)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol | 91744939 | Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)O)C)C)C | 426.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| (3S,4S,6aR,6bS,8aR,9R,12aS,14bR)-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,9-diol | 44246636 | Click to see CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C(C1)O)C)C)C)(C)CO)O)C)C | 458.70 | unknown | via CMAUP database |
| (3S,4S,6aR,8aS,12aR,14bR)-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,12,12a,14,14a-dodecahydropicen-3-ol | 5321408 | Click to see CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C=C1)C)C)C)(C)CO)O)C)C | 440.70 | unknown |
https://doi.org/10.1016/S0021-9673(00)96028-X https://doi.org/10.1021/NP50004A009 |
| (4aR,6aR,6aR,6bR,8aS,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,6a,7,8,9,12,12a,13,14,14a-tetradecahydro-1H-picen-3-ol | 138113838 | Click to see | 426.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| (4aR,6aS,6bR,9S,12aR)-10-hydroxy-9-(hydroxymethyl)-2,2,4a,6a,6b,9,12a-heptamethyl-3,5,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picen-4-one | 25202230 | Click to see | 456.70 | unknown | via CMAUP database |
| (4aR,6bR,9S,10S,12aR,14bS)-9-(hydroxymethyl)-2,2,4a,6a,6b,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-3,4,10-triol | 5321406 | Click to see | 474.70 | unknown |
https://doi.org/10.1248/YAKUSHI1947.108.6_562 https://doi.org/10.1021/NP50004A009 https://doi.org/10.1016/S0021-9673(00)96028-X |
| (4aS,6bR,9S,10S,12aR,14bR)-10-hydroxy-9-(hydroxymethyl)-2,2,4a,6a,6b,9,12a-heptamethyl-4,5,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picen-3-one | 5321410 | Click to see CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(CC1=O)C)C)C)(C)CO)O)C)C | 456.70 | unknown |
https://doi.org/10.1016/S0021-9673(00)96028-X https://doi.org/10.1021/NP50004A009 |
| (6Z,10E,14Z,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene | 25244109 | Click to see CC(=CCCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC=C(C)C)C)C)C | 410.70 | unknown | via CMAUP database |
| [(2S,4aR,4bR,8R,10aR,10bR,12aR)-1,1,4a,8,10a,10b-hexamethyl-8-(4-methylpent-3-enyl)-3,4,4b,5,7,9,10,11,12,12a-decahydro-2H-chrysen-2-yl] acetate | 101677481 | Click to see CC(=CCCC1(CCC2(C(=CCC3C2(CCC4C3(CCC(C4(C)C)OC(=O)C)C)C)C1)C)C)C | 468.80 | unknown | https://doi.org/10.1016/S0031-9422(00)90422-9 |
| [1,1,4a,8,10a,10b-hexamethyl-8-(4-methylpent-3-enyl)-3,4,4b,5,7,9,10,11,12,12a-decahydro-2H-chrysen-2-yl] acetate | 162924048 | Click to see | 468.80 | unknown | https://doi.org/10.1016/S0031-9422(00)90422-9 |
| 24-Methylenedammarenol | 15250873 | Click to see | 440.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| Alpha-Amyrin | 73170 | Click to see | 426.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| Ardisiamamilloside H | 11125847 | Click to see | 911.10 | unknown | https://doi.org/10.1016/S0031-9422(00)80831-6 |
| Beta-Amyrin | 73145 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C)C | 426.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| CID 429190 | 429190 | Click to see CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C(C1)O)C)C)C)(C)CO)O)C)C | 458.70 | unknown | https://doi.org/10.1023/A:1024043104803 |
| Dammaradienol | 13893946 | Click to see | 426.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| ganoderol B | 13934286 | Click to see CC(CCC=C(C)CO)C1CCC2(C1(CC=C3C2=CCC4C3(CCC(C4(C)C)O)C)C)C | 440.70 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| Lanosta-8,24-dien-3-ol | 856 | Click to see | 426.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| Lanosterol | 246983 | Click to see | 426.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| Lupeol | 259846 | Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C | 426.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| Parkeol | 12313974 | Click to see CC(CCC=C(C)C)C1CCC2(C1(CC=C3C2CCC4C3(CCC(C4(C)C)O)C)C)C | 426.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| Soyasapogenol A | 12442849 | Click to see CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C(C1O)O)C)C)C)(C)CO)O)C)C | 474.70 | unknown |
https://doi.org/10.1248/YAKUSHI1947.108.6_562 https://doi.org/10.1021/NP50004A009 https://doi.org/10.1016/S0021-9673(00)96028-X |
| Soyasapogenol B | 115012 | Click to see CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C(C1)O)C)C)C)(C)CO)O)C)C | 458.70 | unknown |
https://doi.org/10.1248/YAKUSHI1947.108.6_562 https://doi.org/10.1021/NP50004A009 https://doi.org/10.1016/S0021-9673(00)96028-X |
| Soyasapogenol C | 3083637 | Click to see | 440.70 | unknown |
https://doi.org/10.1016/S0021-9673(00)96028-X https://doi.org/10.1002/CBER.19370701008 https://doi.org/10.1248/YAKUSHI1881.57.4_464 https://doi.org/10.1002/JLAC.19314890110 https://doi.org/10.1021/NP50004A009 https://doi.org/10.1002/HLCA.19500330333 |
| Soyasapogenol D | 46173903 | Click to see CC1(CC(C2(CCC3(C(=C2C1)CCC4C3(CCC5C4(CCC(C5(C)CO)O)C)C)C)C)OC)C | 472.70 | unknown | https://doi.org/10.1021/NP50004A009 |
| Soyasapogenol E | 13632872 | Click to see CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C(=O)C1)C)C)C)(C)CO)O)C)C | 456.70 | unknown |
https://doi.org/10.1016/S0021-9673(00)96028-X https://doi.org/10.1021/NP50004A009 |
| Soyasapogenol M1 | 12442855 | Click to see CC1(CC2C3=CCC4C5(CCC(C(C5CCC4(C3(CCC2(C=C1)C)C)C)(C)CO)O)C)C | 440.70 | unknown |
https://doi.org/10.1002/JLAC.19314890110 https://doi.org/10.1248/YAKUSHI1881.57.4_464 https://doi.org/10.1002/CBER.19370701008 https://doi.org/10.1002/HLCA.19500330333 |
| Squalene | 638072 | Click to see | 410.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Saccharolipids | |||||
| Licoagroside B | 22297602 | Click to see | 432.40 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Lipids and lipid-like molecules / Sphingolipids / Glycosphingolipids / Simple glycosylceramides / Glycosyl-N-acylsphingosines | |||||
| 2-hydroxy-N-[3-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxydocos-4-en-2-yl]hexadecanamide | 163065585 | Click to see | 772.10 | unknown | https://doi.org/10.1271/BBB1961.46.2855 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Bile acids, alcohols and derivatives / Glycinated bile acids and derivatives | |||||
| 2-[[(4R)-4-[(3R,5S,7R,10S,12S,13R,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]acetic acid | 45109806 | Click to see | 465.60 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Cucurbitacins | |||||
| (3S,8R,9S,13R)-9-ethyl-4,4,13,14-tetramethyl-17-(6-methylheptan-2-yl)-2,3,5,6,7,8,10,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 5316233 | Click to see | 444.80 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| [(3S,8R,9S,13R)-9-ethyl-4,4,13,14-tetramethyl-17-(6-methylheptan-2-yl)-2,3,5,6,7,8,10,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate | 5316234 | Click to see CCC12CCC3(C(CCC3(C1CCC4C2CCC(C4(C)C)OC(=O)C)C)C(C)CCCC(C)C)C | 486.80 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Cycloartanols and derivatives | |||||
| (3R,6S,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methylhept-5-en-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol | 45109773 | Click to see | 426.70 | unknown | via CMAUP database |
| 24-Methylene-9beta,19-cyclo-lanostan-3beta-ol | 9547213 | Click to see | 440.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| CID 16061351 | 16061351 | Click to see | 428.70 | unknown | via CMAUP database |
| Cycloartanol | 12760132 | Click to see | 428.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| Cycloartenol | 92110 | Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C | 426.70 | unknown | via CMAUP database |
| Cycloartenone | 12305360 | Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(=O)C5(C)C)C)C | 424.70 | unknown | via CMAUP database |
| > 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/10.1111/J.1365-2621.1990.TB06074.X |
| (3S,8S,9S,14S,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 134766514 | Click to see | 400.70 | unknown | https://doi.org/10.1111/J.1365-2621.1990.TB06074.X |
| (8R,9S,10S,13R,14S,17R)-17-((2R,5R)-5,6-Dimethylheptan-2-yl)-10,13-dimethyl-4,5,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol | 51051617 | Click to see | 400.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Estrane steroids / Estrogens and derivatives | |||||
| 17-Deoxyestradiol | 5888 | Click to see CC12CCCC1C3CCC4=C(C3CC2)C=CC(=C4)O | 256.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid esters | |||||
| Campesteryl Ferulate | 15056832 | Click to see | 576.80 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal glycosides | |||||
| (3S,5S,6R,7S,8S,9S,10R,13R,14S,15R,17R)-10,13-dimethyl-17-[(2R,5S)-6-methyl-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,6,7,15-tetrol | 163001690 | Click to see | 584.80 | unknown | https://doi.org/10.1021/JO00275A026 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives | |||||
| (3S,8R,9R,10S,13R,14S,17R)-17-[(2R,5S)-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 | 636741 | Click to see | 414.70 | unknown | via CMAUP database |
| (6R)-6-[(8R,9S,10S,13R,14S,17R)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]-3-propan-2-ylhept-3-en-2-one | 129638321 | Click to see | 412.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94844-1 |
| 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/10.1111/J.1365-2621.1990.TB06074.X |
| Npc196776 | 50930798 | Click to see | 410.70 | unknown | via CMAUP database |
| Stigmast-5-en-3-ol | 22012 | Click to see | 414.70 | unknown | https://doi.org/10.1111/J.1365-2621.1990.TB06074.X |
| Stigmasterol | 5280794 | Click to see | 412.70 | unknown | https://doi.org/10.1111/J.1365-2621.1990.TB06074.X |
| > Nucleosides, nucleotides, and analogues / Pyrimidine nucleotides / Pyrimidine nucleotide sugars | |||||
| Udp-Glucose | 8629 | Click to see | 566.30 | unknown | https://doi.org/10.1271/BBB1961.45.2907 |
| UDP-Hexose | 1166 | Click to see | 566.30 | unknown | https://doi.org/10.1271/BBB1961.45.2907 |
| > Nucleosides, nucleotides, and analogues / Pyrimidine nucleotides / Pyrimidine ribonucleotides / Pyrimidine ribonucleoside diphosphates | |||||
| Udp xylose | 19235 | Click to see | 536.28 | unknown | https://doi.org/10.1271/BBB1961.45.2907 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alanine and derivatives | |||||
| (2S)-2-(phenylazaniumyl)propanoate | 6946449 | Click to see CC(C(=O)[O-])[NH2+]C1=CC=CC=C1 | 165.19 | unknown | https://doi.org/10.1007/BF00576124 |
| D-Alanine | 71080 | Click to see | 89.09 | unknown | https://doi.org/10.1007/BF00576124 |
| DL-Alanine | 602 | Click to see CC(C(=O)O)N | 89.09 | unknown | https://doi.org/10.1007/BF00576124 |
| L-Alanine | 5950 | Click to see | 89.09 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acid esters | |||||
| (2R,3S,4R,5R)-6-[2-(dimethylazaniumyl)acetyl]oxy-2,3,4,5-tetrahydroxyhexanoate | 52897285 | Click to see | 281.26 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids | |||||
| 2-amino-3-(1H-imidazol-2-yl)propanoic acid | 300799 | Click to see C1=CN=C(N1)CC(C(=O)O)N | 155.15 | unknown | https://doi.org/10.1007/BF00576124 |
| DL-Threonine | 205 | Click to see CC(C(C(=O)O)N)O | 119.12 | unknown | https://doi.org/10.1007/BF00576124 |
| Lysine, DL- | 866 | Click to see C(CCN)CC(C(=O)O)N | 146.19 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Alpha amino acids / L-alpha-amino acids | |||||
| 3-Imidazolyl-L-alanine | 11955442 | Click to see | 155.15 | unknown | https://doi.org/10.1007/BF00576124 |
| L-Arginine | 6322 | Click to see | 174.20 | unknown |
https://doi.org/10.1002/PMIC.201700366 https://doi.org/10.1007/BF00576124 |
| Lysine | 5962 | Click to see C(CCN)CC(C(=O)O)N | 146.19 | unknown | https://doi.org/10.1007/BF00576124 |
| Nicotianamine | 9882882 | Click to see | 303.31 | unknown | https://doi.org/10.1271/BBB.57.1107 |
| Threonine | 6288 | Click to see CC(C(C(=O)O)N)O | 119.12 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Arginine and derivatives | |||||
| DL-Arginine | 232 | Click to see | 174.20 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Aspartic acid and derivatives | |||||
| (+-)-Aspartic Acid | 424 | Click to see | 133.10 | unknown | https://doi.org/10.1007/BF00576124 |
| D-Aspartic Acid | 83887 | Click to see | 133.10 | unknown | https://doi.org/10.1007/BF00576124 |
| L-Aspartic Acid | 5960 | Click to see | 133.10 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Glutamic acid and derivatives | |||||
| DL-Glutamic acid | 611 | Click to see | 147.13 | unknown | https://doi.org/10.1007/BF00576124 |
| L-Glutamic Acid | 33032 | Click to see | 147.13 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Histidine and derivatives | |||||
| Histidine | 6274 | Click to see C1=C(NC=N1)CC(C(=O)O)N | 155.15 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Isoleucine and derivatives | |||||
| DL-Isoleucine | 791 | Click to see CCC(C)C(C(=O)O)N | 131.17 | unknown | https://doi.org/10.1007/BF00576124 |
| l-Isoleucine | 6306 | Click to see CCC(C)C(C(=O)O)N | 131.17 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Leucine and derivatives | |||||
| DL-leucine | 857 | Click to see | 131.17 | unknown | https://doi.org/10.1007/BF00576124 |
| Leucine | 6106 | Click to see CC(C)CC(C(=O)O)N | 131.17 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Methionine and derivatives | |||||
| (+-)-Methionine | 876 | Click to see | 149.21 | unknown | https://doi.org/10.1007/BF00576124 |
| D-Methionine | 84815 | Click to see CSCCC(C(=O)O)N | 149.21 | unknown | https://doi.org/10.1007/BF00576124 |
| Methionine | 6137 | Click to see CSCCC(C(=O)O)N | 149.21 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Phenylalanine and derivatives | |||||
| D-Phenylalanine | 71567 | Click to see | 165.19 | unknown | https://doi.org/10.1007/BF00576124 |
| DL-Phenylalanine | 994 | Click to see C1=CC=C(C=C1)CC(C(=O)O)N | 165.19 | unknown |
https://doi.org/10.1002/PMIC.201700366 https://doi.org/10.1007/BF00576124 |
| Phenylalanine | 6140 | Click to see C1=CC=C(C=C1)CC(C(=O)O)N | 165.19 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Proline and derivatives | |||||
| DL-Proline | 614 | Click to see C1CC(NC1)C(=O)O | 115.13 | unknown | https://doi.org/10.1007/BF00576124 |
| Proline | 145742 | Click to see C1CC(NC1)C(=O)O | 115.13 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Serine and derivatives | |||||
| DL-Serine | 617 | Click to see | 105.09 | unknown | https://doi.org/10.1007/BF00576124 |
| L-Serine | 5951 | Click to see | 105.09 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Tyrosine and derivatives | |||||
| DL-Tyrosine | 1153 | Click to see C1=CC(=CC=C1CC(C(=O)O)N)O | 181.19 | unknown | https://doi.org/10.1007/BF00576124 |
| L-Tyrosine | 6057 | Click to see | 181.19 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Valine and derivatives | |||||
| DL-valine | 1182 | Click to see | 117.15 | unknown | https://doi.org/10.1007/BF00576124 |
| Valine | 6287 | Click to see CC(C)C(C(=O)O)N | 117.15 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Cysteine and derivatives | |||||
| 2-Azaniumyl-3-((2-Azaniumyl-2-Carboxylatoethyl)Disulfanyl)Propanoate | 595 | Click to see | 240.30 | unknown | https://doi.org/10.1007/BF00576124 |
| Cystine, meso- | 6991966 | Click to see | 240.30 | unknown | https://doi.org/10.1007/BF00576124 |
| D-Cystine | 6857538 | Click to see | 240.30 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Cysteine and derivatives / L-cysteine-S-conjugates | |||||
| (-)-Cystine | 67678 | Click to see | 240.30 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Peptides / Dipeptides | |||||
| Valylglutamic acid | 7009623 | Click to see CC(C)C(C(=O)NC(CCC(=O)O)C(=O)O)N | 246.26 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Peptides / Oligopeptides | |||||
| His-His-Leu | 9844201 | Click to see | 405.50 | unknown | https://doi.org/10.1021/JF001135R |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives | |||||
| [(1S,2Z,8R,9R,11S)-1-hydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8]tetradeca-2,12-dien-9-yl] (E)-5-acetyloxypent-3-enoate | 5318986 | Click to see CC1=CC2C(C(CC3(C=CC1(O3)O)C)OC(=O)CC=CCOC(=O)C)C(=C)C(=O)O2 | 418.40 | unknown | via CMAUP database |
| cis-Aconitic acid | 643757 | Click to see | 174.11 | unknown | via CMAUP database |
| Npc283557 | 5289496 | Click to see | 171.08 | unknown | via CMAUP database |
| trans-Aconitic acid | 444212 | Click to see | 174.11 | unknown | via CMAUP database |
| > Organic acids and derivatives / Peptidomimetics / Hybrid peptides | |||||
| D-pantothenoyl-L-cysteine | 440217 | Click to see | 322.38 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Organic nitrogen compounds / Organonitrogen compounds / Amines / Alkanolamines / 1,2-aminoalcohols | |||||
| Sphingosine | 5280335 | Click to see CCCCCCCCCCCCCC=CC(C(CO)N)O | 299.50 | unknown | https://doi.org/10.1271/BBB1961.46.2855 |
| > Organic nitrogen compounds / Organonitrogen compounds / Amines / Primary amines / Monoalkylamines | |||||
| 4-aminobutylazanium chloride | 85247068 | Click to see | 124.61 | unknown | via CMAUP database |
| Cadaverine | 273 | Click to see | 102.18 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1081074/ https://doi.org/10.1016/0031-9422(90)85450-T |
| Putrescine | 1045 | Click to see | 88.15 | unknown | https://doi.org/10.1016/0031-9422(90)85450-T |
| > Organic nitrogen compounds / Organonitrogen compounds / Amines / Secondary amines / Dialkylamines | |||||
| N,N'-bis(3-aminopropyl)(1,4-13C2)butane-1,4-diamine | 10655817 | Click to see | 204.33 | unknown | via CMAUP database |
| Spermidine | 1102 | Click to see C(CCNCCCN)CN | 145.25 | unknown | https://doi.org/10.1016/0031-9422(90)85450-T |
| Spermine | 1103 | Click to see | 202.34 | unknown | https://doi.org/10.1016/0031-9422(90)85450-T |
| Sym-homospermidine | 368 | Click to see C(CCNCCCCN)CN | 159.27 | unknown | https://doi.org/10.1016/0031-9422(90)85450-T |
| > Organic nitrogen compounds / Organonitrogen compounds / Guanidines | |||||
| Agmatine | 199 | Click to see | 130.19 | unknown | https://doi.org/10.1016/0031-9422(90)85450-T |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclic alcohols and derivatives | |||||
| 6-(Hydroxymethyl)-6,10,17,17,20,22,23-heptamethyl-2-oxapentacyclo[12.7.1.13,11.05,10.015,20]tricos-14-en-7-ol | 5321409 | Click to see | 458.70 | unknown | https://doi.org/10.1021/NP50004A009 |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Inositol phosphates | |||||
| Phytic acid | 890 | Click to see C1(C(C(C(C(C1OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O | 660.04 | unknown |
https://doi.org/10.1021/JF00049A024 https://doi.org/10.1021/JF00048A015 |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives | |||||
| (1R,3R,4R,5S)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid | 7067335 | Click to see | 354.31 | unknown | https://doi.org/10.1007/BF00575726 |
| 3-{[3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexane-1-carboxylic acid | 348159 | 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 | https://doi.org/10.1007/BF00575726 |
| 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 |
https://doi.org/10.1007/BF00575726 https://doi.org/10.1016/S0021-9673(01)87655-X |
| Neochlorogenic acid | 5280633 | 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 | https://doi.org/10.1007/BF00575726 |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols / Cyclohexanols | |||||
| 6-Methoxycyclohexane-1,2,3,4,5-pentol | 230881 | Click to see COC1C(C(C(C(C1O)O)O)O)O | 194.18 | unknown |
https://doi.org/10.1021/JF00111A011 https://doi.org/10.1016/S0031-9422(00)80831-6 https://doi.org/10.1016/S0031-9422(00)80263-0 https://doi.org/10.1016/S0031-9422(96)00795-9 https://doi.org/10.1271/BBB1961.49.933 |
| An inositol | 892 | Click to see | 180.16 | unknown |
https://doi.org/10.1021/JF00111A011 https://doi.org/10.1016/S0031-9422(00)80831-6 https://doi.org/10.1271/BBB1961.49.933 |
| Npc236271 | 440078 | Click to see | 194.18 | unknown | https://doi.org/10.1021/JF00123A066 |
| Ononitol | 5320294 | Click to see | 194.18 | unknown | https://doi.org/10.1016/S0031-9422(00)80831-6 |
| Ononitol, (+)- | 164619 | Click to see | 194.18 | unknown | https://doi.org/10.1021/JF00123A066 |
| Sequoyitol | 439990 | Click to see | 194.18 | unknown |
https://doi.org/10.1021/JF00111A011 https://doi.org/10.1021/JF00123A066 |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / 2-deoxystreptamine aminoglycosides / 4,5-disubstituted 2-deoxystreptamines | |||||
| Neomycin | 8378 | Click to see | 614.60 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / C-glycosyl compounds | |||||
| Delphinidin, 3-fructoside | 54605857 | Click to see C1C(CC2C(C1O)CC(C(O2)C3=CC(=C(C(=C3)O)O)O)OC4(C(C(C(O4)CO)O)O)CO)O | 474.50 | unknown | via CMAUP database |
| Digalactosylglycerol | 129663930 | Click to see | 416.37 | unknown | https://doi.org/10.1271/BBB1961.49.933 |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds | |||||
| (1S,2S,4R,5S)-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexane-1,2,3,4,5-pentol | 129629405 | Click to see C(C1C(C(C(C(O1)OC2C(C(C(C(C2O)O)O)O)O)O)O)O)O | 342.30 | unknown | https://doi.org/10.1271/BBB1961.49.933 |
| Ciceritol | 10142653 | Click to see | 518.50 | unknown | https://doi.org/10.1271/BBB1961.49.933 |
| Galactopinitol A | 25201084 | Click to see | 356.32 | unknown | https://doi.org/10.1271/BBB1961.49.933 |
| Galactopinitol B | 101926786 | Click to see | 356.32 | unknown | https://doi.org/10.1271/BBB1961.49.933 |
| Sucrose | 5988 | Click to see | 342.30 | unknown |
https://doi.org/10.1271/BBB.56.99 https://doi.org/10.1271/BBB1961.49.933 https://doi.org/10.1111/J.1365-2621.1983.TB09208.X |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides | |||||
| Phenyl beta-D-glucopyranosiduronic acid | 87235 | Click to see C1=CC=C(C=C1)OC2C(C(C(C(O2)C(=O)O)O)O)O | 270.23 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides | |||||
| D-(-)-Fructose | 5984 | Click to see | 180.16 | unknown | https://doi.org/10.1111/J.1365-2621.1983.TB09208.X |
| D-Fructose | 2723872 | Click to see | 180.16 | unknown | https://doi.org/10.1111/J.1365-2621.1983.TB09208.X |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Hexoses | |||||
| D-Glucose | 5793 | Click to see C(C1C(C(C(C(O1)O)O)O)O)O | 180.16 | unknown | https://doi.org/10.1111/J.1365-2621.1983.TB09208.X |
| D(+)-Glucose | 107526 | Click to see C(C(C(C(C(C=O)O)O)O)O)O | 180.16 | unknown | https://doi.org/10.1111/J.1365-2621.1983.TB09208.X |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Oligosaccharides | |||||
| Gal(a1-6)D-Ido(a1-6)Glc(a1-2b)Psif | 132990894 | Click to see | 666.60 | unknown |
https://doi.org/10.1271/BBB1961.49.933 https://doi.org/10.1271/BBB.56.99 https://doi.org/10.1111/J.1365-2621.1983.TB09208.X |
| Raffinose | 439242 | Click to see | 504.40 | unknown |
https://doi.org/10.1271/BBB1961.49.933 https://doi.org/10.1111/J.1365-2621.1983.TB09208.X https://doi.org/10.1271/BBB.56.99 https://doi.org/10.1016/S0031-9422(00)80263-0 |
| Stachyose | 439531 | Click to see | 666.60 | unknown |
https://doi.org/10.1271/BBB1961.49.933 https://doi.org/10.1271/BBB.56.99 https://doi.org/10.1111/J.1365-2621.1983.TB09208.X |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar acids and derivatives | |||||
| 2,3,3-trideuterio-2,3-dihydroxy(1,2-13C2)propanoic acid | 10887854 | Click to see C(C(C(=O)O)O)O | 111.08 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzoquinones / P-benzoquinones | |||||
| 5-O-Methylembelin | 171489 | Click to see CCCCCCCCCCCC1=C(C(=O)C=C(C1=O)OC)O | 308.40 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones | |||||
| (1S,4S,6S,9R,13R,14R)-13-ethenyl-6-hydroxy-5,5,9,13-tetramethyl-15-oxatetracyclo[8.5.0.01,14.04,9]pentadec-10-ene-7,12-dione | 163007839 | Click to see | 330.40 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones | |||||
| Phlorisobutyrophenone | 5326317 | Click to see CC(C)C(=O)C1=C(C=C(C=C1O)O)O | 196.20 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Azoles / Imidazoles | |||||
| Allantoin | 204 | Click to see C1(C(=O)NC(=O)N1)NC(=O)N | 158.12 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1064470/ https://doi.org/10.1007/BF00576124 |
| > Organoheterocyclic compounds / Azolidines / Imidazolidines / Hydantoins / Allantoins | |||||
| (S)-(+)-allantoin | 439714 | Click to see | 158.12 | unknown | https://doi.org/10.1007/BF00576124 |
| > Organoheterocyclic compounds / Benzodiazepines / 1,4-benzodiazepines | |||||
| Nordazepam | 2997 | Click to see C1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3 | 270.71 | unknown | https://doi.org/10.1016/0024-3205(91)90347-E |
| > Organoheterocyclic compounds / Diazanaphthalenes / Naphthyridines | |||||
| Benzo(c)(2,7)naphthyridin-4(3H)-one | 5748566 | Click to see | 196.20 | unknown | https://doi.org/10.1016/S0040-4039(00)84806-6 |
| > Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives / 6-aminopurines | |||||
| Adenine | 190 | Click to see C1=NC2=NC=NC(=C2N1)N | 135.13 | unknown | https://doi.org/10.4327/JSNFS.38.129 |
| > 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 |
| Tryptophan | 6305 | Click to see C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)N | 204.22 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Organoheterocyclic compounds / Indoles and derivatives / Indolyl carboxylic acids and derivatives / Indole-3-acetic acid derivatives | |||||
| Indole-3-acetic acid | 802 | Click to see C1=CC=C2C(=C1)C(=CN2)CC(=O)O | 175.18 | unknown | https://doi.org/10.1080/00380768.1991.10415039 |
| > Organoheterocyclic compounds / Indolizidines | |||||
| GlyTouCan:G00082GU | 442645 | Click to see | 157.21 | unknown | https://doi.org/10.1021/JO00275A026 |
| > Organoheterocyclic compounds / Pyrans / Pyranones and derivatives | |||||
| Kojic Acid | 3840 | Click to see | 142.11 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyridines and derivatives / Pyridinecarboxylic acids and derivatives / Pyridinecarboxylic acids | |||||
| Nicotinic Acid | 938 | Click to see | 123.11 | unknown | https://doi.org/10.1111/J.1439-037X.1991.TB00948.X |
| > Organoheterocyclic compounds / Quinolines and derivatives / Furanoquinolines | |||||
| Kokusagine | 5318829 | Click to see | 243.21 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Quinolines and derivatives / Quinolones and derivatives / Hydroquinolones | |||||
| 8-(2,3-Dihydroxy-3-methoxybutoxy)-4-methoxy-1-methylquinolin-2(1H)-one | 16219364 | Click to see | 323.34 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Tetrapyrroles and derivatives / Bilirubins | |||||
| 4E,15Z-Bilirubin IXa | 21252250 | Click to see CC1=C(NC(=C1CCC(=O)O)CC2=C(C(=C(N2)C=C3C(=C(C(=O)N3)C)C=C)C)CCC(=O)O)C=C4C(=C(C(=O)N4)C=C)C | 584.70 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids | |||||
| 3-(4-Hydroxy-3-Methoxyphenyl)Prop-2-Enoic Acid | 709 | Click to see | 194.18 | unknown | https://doi.org/10.1007/BF00575726 |
| 4-Coumaric acid | 322 | Click to see | 164.16 | unknown |
https://doi.org/10.1007/BF00575726 https://doi.org/10.1016/0098-8472(86)90054-7 |
| Caffeic Acid | 689043 | Click to see | 180.16 | unknown |
https://doi.org/10.1016/0098-8472(86)90054-7 https://doi.org/10.1021/JF00123A028 https://doi.org/10.1016/S0021-9673(01)87655-X |
| Ferulic Acid | 445858 | Click to see | 194.18 | unknown |
https://doi.org/10.1021/JF00123A028 https://doi.org/10.1007/BF00575726 https://doi.org/10.1016/S0021-9673(01)87655-X https://doi.org/10.1021/NP980566P https://doi.org/10.1016/0098-8472(86)90054-7 |
| Isoferulic Acid | 736186 | Click to see | 194.18 | unknown | https://doi.org/10.1021/JF00123A028 |
| O-Coumaric Acid | 637540 | Click to see | 164.16 | unknown | https://doi.org/10.1016/S0021-9673(01)87655-X |
| P-Coumaric Acid | 637542 | Click to see | 164.16 | unknown |
https://doi.org/10.1021/JF00123A028 https://doi.org/10.1007/BF00575726 https://doi.org/10.1016/S0021-9673(01)87655-X https://doi.org/10.1016/0098-8472(86)90054-7 |
| Sinapinic acid | 637775 | Click to see COC1=CC(=CC(=C1O)OC)C=CC(=O)O | 224.21 | unknown |
https://doi.org/10.1021/JF00123A028 https://doi.org/10.1016/S0021-9673(01)87655-X |
| > Phenylpropanoids and polyketides / Depsides and depsidones | |||||
| Squamatic acid | 5321482 | Click to see CC1=CC(=C(C(=C1C(=O)O)O)C)OC(=O)C2=C(C(=C(C=C2C)OC)C(=O)O)O | 390.30 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Diarylheptanoids / Linear diarylheptanoids | |||||
| (4E)-7-(4-Hydroxy-3,5-dimethoxyphenyl)-1-(4-hydroxy-3-methoxyphenyl)-4-hepten-3-one | 5317592 | Click to see | 386.40 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins | |||||
| Catechin | 9064 | Click to see | 290.27 | unknown | https://doi.org/10.1016/S0021-9673(01)87655-X |
| Epicatechin | 72276 | Click to see | 290.27 | unknown |
https://doi.org/10.1016/S0021-9673(01)87655-X https://doi.org/10.1093/AJCN/68.6.1480S |
| > Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones | |||||
| (+-)-Naringenin | 932 | Click to see | 272.25 | unknown | https://doi.org/10.1016/0098-8472(86)90054-7 |
| (2R)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one | 667495 | Click to see C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O | 272.25 | unknown | https://doi.org/10.1016/0098-8472(86)90054-7 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavones | |||||
| Apigenin | 5280443 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O | 270.24 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols | |||||
| Fisetin | 5281614 | Click to see | 286.24 | unknown | https://doi.org/10.1007/BF02259383 |
| Kaempferol | 5280863 | Click to see | 286.24 | unknown |
https://doi.org/10.1007/BF02259383 https://doi.org/10.1016/0098-8472(86)90054-7 https://doi.org/10.1034/J.1399-3054.1992.860213.X https://doi.org/10.1007/BF00575726 https://doi.org/10.1016/S0021-9673(01)87655-X https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1066785/ |
| Quercetin | 5280343 | Click to see | 302.23 | unknown |
https://doi.org/10.1016/S0021-9673(01)87655-X https://doi.org/10.1016/0098-8472(86)90054-7 https://doi.org/10.1007/BF00575726 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanins / Anthocyanidin-3-O-glycosides | |||||
| Chrysanthemin | 44256715 | Click to see | 449.40 | unknown | via CMAUP database |
| Cyanidin 3-galactoside | 176457 | Click to see | 484.80 | unknown | via CMAUP database |
| cyanidin 3-O-glucoside | 197081 | Click to see | 484.80 | unknown | via CMAUP database |
| Cyanidin-3-glucoside | 92131208 | Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O | 449.40 | unknown | via CMAUP database |
| Delphinidin 3-glucoside chloride | 165558 | Click to see C1=C(C=C(C(=C1O)O)O)C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O.[Cl-] | 500.80 | unknown | via CMAUP database |
| Delphinidin 3-O-glucoside cation | 443650 | Click to see C1=C(C=C(C(=C1O)O)O)C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O | 465.40 | unknown | via CMAUP database |
| Idaein | 44256700 | Click to see | 449.40 | unknown | via CMAUP database |
| Kuromanin | 441667 | Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O | 449.40 | unknown |
https://doi.org/10.3892/OR.10.2.297 https://doi.org/10.1021/JF010550W |
| Pelargonidin 3-O-glucoside | 443648 | Click to see | 433.40 | unknown | via CMAUP database |
| Petunidin 3-Glucoside | 443651 | Click to see | 479.40 | unknown | https://doi.org/10.1021/JF010550W |
| Petunidin-3-O-glucoside chloride | 176449 | Click to see | 514.90 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanins / Anthocyanidin-5-O-glycosides | |||||
| Cyanin | 441688 | Click to see | 611.50 | unknown | https://doi.org/10.1271/BBB.60.589 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides / Flavonoid 8-C-glycosides | |||||
| 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-8-[(2R,3S,4R,5S)-3,4,5-trihydroxyoxan-2-yl]chromen-4-one | 133562448 | Click to see | 580.50 | unknown | https://doi.org/10.1016/S0031-9422(00)82629-1 |
| 2-(3,4-Dihydroxyphenyl)-8-beta-D-glucopyranosyl-5,7-dihydroxy-6-beta-D-xylopyranosyl-4H-1-benzopyran-4-one | 73802481 | Click to see C1C(C(C(C(O1)C2=C(C(=C3C(=C2O)C(=O)C=C(O3)C4=CC(=C(C=C4)O)O)C5C(C(C(C(O5)CO)O)O)O)O)O)O)O | 580.50 | unknown | https://doi.org/10.1016/S0031-9422(00)82629-1 |
| 5,7-Dihydroxy-2-(4-hydroxyphenyl)-8-(3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)-6-(3,4,5-trihydroxyoxan-2-yl)chromen-4-one | 13644660 | Click to see | 564.50 | unknown | https://doi.org/10.1016/S0031-9422(00)82629-1 |
| 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one | 5378180 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O | 432.40 | unknown | https://doi.org/10.1016/S0031-9422(00)82629-1 |
| 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one | 154497677 | Click to see | 432.40 | unknown | https://doi.org/10.1016/S0031-9422(00)82629-1 |
| 8-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3R,4R,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one | 162848612 | Click to see | 578.50 | unknown | https://doi.org/10.1016/S0031-9422(00)82629-1 |
| 8-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one | 129661210 | Click to see | 578.50 | unknown | https://doi.org/10.1016/S0031-9422(00)82629-1 |
| 8-Arabinosyl-6-glucosylluteolin | 3542481 | Click to see | 580.50 | unknown | https://doi.org/10.1016/S0031-9422(00)82629-1 |
| Apigenin-8-C-glucoside-2'-rhamnoside | 5874704 | Click to see | 578.50 | unknown | https://doi.org/10.1016/S0031-9422(00)82629-1 |
| Carlinoside | 442584 | Click to see C1C(C(C(C(O1)C2=C3C(=C(C(=C2O)C4C(C(C(C(O4)CO)O)O)O)O)C(=O)C=C(O3)C5=CC(=C(C=C5)O)O)O)O)O | 580.50 | unknown | https://doi.org/10.1016/S0031-9422(00)82629-1 |
| Isocarlinoside | 21576182 | Click to see C1C(C(C(C(O1)C2=C(C(=C3C(=C2O)C(=O)C=C(O3)C4=CC(=C(C=C4)O)O)C5C(C(C(C(O5)CO)O)O)O)O)O)O)O | 580.50 | unknown | https://doi.org/10.1016/S0031-9422(00)82629-1 |
| Isoschaftoside | 3084995 | Click to see C1C(C(C(C(O1)C2=C(C(=C3C(=C2O)C(=O)C=C(O3)C4=CC=C(C=C4)O)C5C(C(C(C(O5)CO)O)O)O)O)O)O)O | 564.50 | unknown | https://doi.org/10.1016/S0031-9422(00)82629-1 |
| Vitexin | 5280441 | Click to see | 432.40 | unknown | https://doi.org/10.1016/S0031-9422(00)82629-1 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides | |||||
| 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxychromen-4-one | 51402807 | Click to see | 464.40 | unknown | https://doi.org/10.1007/BF00580089 |
| 3-[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one | 162869846 | Click to see | 756.70 | unknown | https://doi.org/10.1055/S-2002-32545 |
| 3-[6-[[4,5-Dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one | 74978096 | Click to see | 756.70 | unknown | https://doi.org/10.1055/S-2002-32545 |
| 5,7-Dihydroxy-2-(4-Hydroxyphenyl)-3-(3,4,5-Trihydroxy-6-((3,4,5-Trihydroxy-6-Methyloxan-2-Yl)Oxymethyl)Oxan-2-Yl)Oxychromen-4-One | 12313332 | Click to see | 594.50 | unknown | https://doi.org/10.1055/S-2002-32545 |
| Astragalin | 5282102 | Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O | 448.40 | unknown |
https://doi.org/10.1007/BF02259383 https://doi.org/10.1007/BF00580089 |
| Biorobin | 15944778 | Click to see | 594.50 | unknown | https://doi.org/10.1055/S-2002-32545 |
| Kaempferol 3-gentiobioside | 9960512 | Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O)O | 610.50 | unknown | https://doi.org/10.1007/BF02259383 |
| Kaempferol 3-neohesperidoside | 5318761 | Click to see CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)CO)O)O)O)O)O | 594.50 | unknown | https://doi.org/10.1007/BF02259383 |
| Kaempferol-3-O-Rutinoside | 5318767 | Click to see | 594.50 | unknown |
https://doi.org/10.1007/BF00580089 https://doi.org/10.1007/BF02259383 https://doi.org/10.1055/S-2002-32545 |
| Mauritianin | 5459192 | Click to see CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)OC6C(C(C(C(O6)C)O)O)O)O)O)O)O)O | 740.70 | unknown | https://doi.org/10.1055/S-2002-32545 |
| Mauritianin | 10919701 | Click to see | 740.70 | unknown | https://doi.org/10.1055/S-2002-32545 |
| Quercitrin | 5280459 | Click to see | 448.40 | unknown | https://doi.org/10.1016/S0021-9673(01)87655-X |
| Rutin | 5280805 | Click to see | 610.50 | unknown | https://doi.org/10.1007/BF00580089 |
| Sophoraflavonoloside | 5282155 | Click to see C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)O | 610.50 | unknown | https://doi.org/10.1007/BF02259383 |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides | |||||
| Robinin | 5281693 | Click to see | 740.70 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| > 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 |
| 2-(4-Hydroxyphenyl)chromenylium-5,7-diol | 441647 | Click to see C1=CC(=CC=C1C2=[O+]C3=CC(=CC(=C3C=C2)O)O)O | 255.24 | unknown | https://doi.org/10.1016/S0031-9422(01)00378-8 |
| Cyanidin Chloride | 68247 | Click to see | 322.69 | unknown | via CMAUP database |
| Gastrotelos | 6917937 | Click to see | 340.71 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 6-O-methylated flavonoids | |||||
| Hispidulin | 5281628 | Click to see | 300.26 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids | |||||
| Cirsimaritin | 188323 | Click to see COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)O)O)OC | 314.29 | unknown | via CMAUP database |
| Eupatorin | 97214 | Click to see COC1=C(C=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC)O)O | 344.30 | unknown | via CMAUP database |
| Genkwanin | 5281617 | Click to see | 284.26 | unknown | via CMAUP database |
| Sakuranetin | 73571 | Click to see | 286.28 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Isoflavonoids / Coumestans | |||||
| 2,3-Dihydro-10-hydroxy-3,3-dimethyl-1H,7H-pyrano(2',3':6,7)benzofuro(3,2-c)(1)benzopyran-7-one | 5281809 | Click to see | 336.30 | unknown | https://doi.org/10.1002/JPS.2600640504 |
| Coumestrin | 74977392 | Click to see | 430.40 | unknown | https://doi.org/10.1016/S0031-9422(00)82649-7 |
| Coumestrol | 5281707 | Click to see C1=CC2=C(C=C1O)OC3=C2C(=O)OC4=C3C=CC(=C4)O | 268.22 | unknown |
https://doi.org/10.1021/NP50048A030 https://doi.org/10.1016/0098-8472(86)90054-7 https://doi.org/10.1016/S0031-9422(00)82649-7 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1075809/ https://doi.org/10.1006/JFCA.2000.0948 https://doi.org/10.1016/0098-8472(85)90006-1 |
| Isosojagol | 16744613 | Click to see | 336.30 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| Phaseol | 44257530 | Click to see | 336.30 | unknown | https://doi.org/10.1021/NP50048A030 |
| > Phenylpropanoids and polyketides / Isoflavonoids / Furanoisoflavonoids / Pterocarpans | |||||
| (-)-Phaseolin | 121232634 | Click to see | 324.40 | unknown | https://doi.org/10.1002/PMIC.201700366 |
| (1R,6S,13R)-6-prop-1-en-2-yl-7,11,20-trioxapentacyclo[11.7.0.02,10.04,8.014,19]icosa-2(10),3,8,14(19),15,17-hexaene-13,17-diol | 6454112 | Click to see CC(=C)C1CC2=CC3=C(C=C2O1)OCC4(C3OC5=C4C=CC(=C5)O)O | 338.40 | unknown |
https://doi.org/10.1021/JF801905Y https://doi.org/10.1016/0031-9422(95)00404-U |
| (1S,6R,13S)-6-prop-1-en-2-yl-7,11,20-trioxapentacyclo[11.7.0.02,10.04,8.014,19]icosa-2(10),3,8,14(19),15,17-hexaene-13,17-diol | 101682262 | Click to see | 338.40 | unknown | https://doi.org/10.1016/0031-9422(95)00404-U |
| 1,2-Dihydro-2-(1-methylethenyl)-6H-benzofuro[3,2-c]furo[3,2-g][1]benzopyran-6a,9(11aH)-diol, 9CI | 12002084 | Click to see | 338.40 | unknown |
https://doi.org/10.1021/JF801905Y https://doi.org/10.1016/0031-9422(95)00404-U |
| 2,2-Dimethyl-2H,6H-benzofuro[3,2-c]pyrano[2,3-h][1]benzopyran-6a,9(11aH)-diol, 9CI | 4475100 | Click to see | 338.40 | unknown |
https://doi.org/10.1021/JF801905Y https://doi.org/10.1016/0031-9422(95)00404-U |
| 3,3-Dimethyl-3H,7H-benzofuro[3,2-c]pyrano[3,2-g][1]benzopyran-7a,10(12aH)-diol, 9CI | 4640119 | Click to see | 338.40 | unknown |
https://doi.org/10.1021/JF801905Y https://doi.org/10.1016/0031-9422(95)00404-U |
| 6H-Benzofuro[3,2-c][1]benzopyran-3,6a,9(11aH)-triol, 9CI | 4629012 | Click to see | 272.25 | unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2671905/ https://doi.org/10.1016/0031-9422(95)00404-U |
| CID 187147 | 187147 | Click to see | 354.40 | unknown | https://doi.org/10.1016/0031-9422(95)00404-U |
| CID 5317742 | 5317742 | Click to see CC(=CCC1=CC2=C(C=C1OC)OCC3(C2OC4=C3C=CC(=C4)O)O)C | 354.40 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2671905/ |
| Glyceocarpin | 10617107 | Click to see CC(=CCC1=CC2=C(C=C1O)OCC3(C2OC4=C3C=CC(=C4)O)O)C | 340.40 | unknown | https://doi.org/10.1016/0031-9422(95)00404-U |
| Glyceofuran | 629096 | Click to see | 354.40 | unknown | https://doi.org/10.1016/0031-9422(95)00404-U |
| glyceollidin II | 85206973 | Click to see | 340.40 | unknown |
https://doi.org/10.1021/JF991146O https://doi.org/10.1016/0031-9422(95)00404-U |
| Glyceollin I | 162807 | Click to see | 338.40 | unknown |
https://doi.org/10.1515/BCHM3.1986.367.2.797 https://doi.org/10.1016/S0031-9422(00)81421-1 https://doi.org/10.1021/JF801905Y https://doi.org/10.1021/JF00012A010 https://doi.org/10.1016/0031-9422(95)00404-U https://doi.org/10.1515/ZNC-1986-1-229 https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1075809/ |
| Glyceollin Ii | 181883 | Click to see CC1(C=CC2=CC3=C(C=C2O1)OCC4(C3OC5=C4C=CC(=C5)O)O)C | 338.40 | unknown |
https://doi.org/10.1021/JF801905Y https://doi.org/10.1016/0031-9422(95)00404-U |
| Glyceollin Iii | 11954193 | Click to see | 338.40 | unknown | https://doi.org/10.1016/0031-9422(95)00404-U |
| Glycinol | 129648 | Click to see | 272.25 | unknown | https://doi.org/10.1016/0031-9422(95)00404-U |
| > Phenylpropanoids and polyketides / Isoflavonoids / Isoflav-2-enes / Isoflavones | |||||
| 5,8-Dideuterio-7-hydroxy-6-methoxy-3-(2,3,5,6-tetradeuterio-4-hydroxyphenyl)chromen-4-one | 11994876 | Click to see | 290.30 | unknown | via CMAUP database |
| 8-Prenyldaidzein | 14841119 | Click to see | 322.40 | unknown | via CMAUP database |
| CID 11777207 | 11777207 | Click to see | 257.21 | unknown | via CMAUP database |
| Daidzein | 5281708 | Click to see | 254.24 | unknown |
https://doi.org/10.1016/S0021-9673(01)87655-X https://doi.org/10.1016/0098-8472(86)90054-7 https://doi.org/10.1021/JF801905Y https://doi.org/10.1016/0031-9422(83)80013-2 https://doi.org/10.1016/S0021-9673(97)00989-8 https://doi.org/10.1016/0731-7085(95)01619-8 https://doi.org/10.1021/JF00123A028 https://doi.org/10.1248/CPB.33.3834 https://doi.org/10.1021/JF00063A016 https://doi.org/10.1207/S15327914NC4802_5 https://doi.org/10.1021/NP010606G https://doi.org/10.1021/JF00044A017 https://doi.org/10.1021/JF00044A016 https://doi.org/10.1016/S0031-9422(00)82649-7 https://doi.org/10.1093/AJCN/68.6.1480S https://doi.org/10.1016/0002-8223(94)91939-9 https://doi.org/10.1016/0098-8472(85)90006-1 https://doi.org/10.1006/JFCA.2000.0948 https://doi.org/10.1007/BF00575726 https://doi.org/10.1021/JF00110A035 https://doi.org/10.1021/NP980566P https://doi.org/10.1080/00380768.1991.10415022 https://doi.org/10.1093/AJCN/68.6.1474S https://doi.org/10.1021/JF00035A027 https://doi.org/10.1002/PMIC.201700366 https://doi.org/10.1016/S0731-7085(00)00264-8 |
| Genistein | 5280961 | Click to see | 270.24 | unknown |
https://doi.org/10.7326/0003-4819-146-12-200706190-00005 https://doi.org/10.1016/0098-8472(86)90054-7 https://doi.org/10.1021/NP070230S https://doi.org/10.1021/JF801905Y https://doi.org/10.1271/BBB.56.99 https://doi.org/10.1016/S0278-6915(02)00305-8 https://doi.org/10.1016/S0021-9673(97)00989-8 https://doi.org/10.1016/0731-7085(95)01619-8 https://doi.org/10.1093/AJCN/68.6.1486S https://doi.org/10.1021/JF00123A028 https://doi.org/10.1248/CPB.33.3834 https://doi.org/10.1021/JF00063A016 https://doi.org/10.1207/S15327914NC4802_5 https://doi.org/10.1021/NP010606G https://doi.org/10.1021/JF00044A017 https://doi.org/10.1021/JF00044A016 https://doi.org/10.1016/S0031-9422(00)82649-7 https://doi.org/10.1210/JC.2006-2295 https://doi.org/10.1093/AJCN/68.6.1480S https://doi.org/10.1016/0002-8223(94)91939-9 https://doi.org/10.1016/0098-8472(85)90006-1 https://doi.org/10.1006/JFCA.2000.0948 https://doi.org/10.1271/BBB1961.55.2227 https://doi.org/10.1007/BF00575726 https://doi.org/10.1021/JF00110A035 https://doi.org/10.1021/NP980566P https://doi.org/10.1080/00380768.1991.10415022 https://doi.org/10.1093/AJCN/68.6.1474S https://doi.org/10.1021/JF00035A027 https://doi.org/10.1093/JXB/47.6.785 https://doi.org/10.1016/S0731-7085(00)00264-8 |
| Genistein(1-) | 25201420 | Click to see C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)[O-])O)O | 269.23 | unknown | via CMAUP database |
| Glycitein | 5317750 | Click to see | 284.26 | unknown |
https://doi.org/10.1021/JF801905Y https://doi.org/10.1021/NP980566P https://doi.org/10.1021/NP010606G https://doi.org/10.1021/JF00044A017 https://doi.org/10.1093/AJCN/68.6.1474S |
| > Phenylpropanoids and polyketides / Isoflavonoids / Isoflavonoid C-glycosides | |||||
| 5,7-dihydroxy-3-(4-hydroxyphenyl)-8-[(2S,4R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one | 44257270 | Click to see C1=CC(=CC=C1C2=COC3=C(C2=O)C(=CC(=C3C4C(C(C(C(O4)CO)O)O)O)O)O)O | 432.40 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Isoflavonoids / Isoflavonoid O-glycosides | |||||
| [(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[3-(4-hydroxyphenyl)-6-methoxy-4-oxochromen-7-yl]oxyoxan-2-yl]methyl acetate | 125181540 | Click to see | 488.40 | unknown | https://doi.org/10.1271/BBB1961.55.859 |
| [3,4,5-Trihydroxy-6-[3-(4-hydroxyphenyl)-6-methoxy-4-oxochromen-7-yl]oxyoxan-2-yl]methyl acetate | 53398650 | Click to see | 488.40 | unknown | https://doi.org/10.1080/00021369.1991.10870668 |
| 3-(4-hydroxyphenyl)-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | 44257214 | Click to see | 416.40 | unknown | via CMAUP database |
| 3-(4-methoxyphenyl)-7-[(2S,4S,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | 44257215 | Click to see COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OC4C(C(C(C(O4)CO)O)O)O | 430.40 | unknown |
https://doi.org/10.1007/BF00580089 https://doi.org/10.1016/0031-9422(83)80013-2 |
| 3-Oxo-3-[[3,4,5-trihydroxy-6-[3-(4-hydroxyphenyl)-6-methoxy-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]propanoic acid | 92024097 | Click to see | 532.40 | unknown |
https://doi.org/10.1080/00021369.1991.10870966 https://doi.org/10.1021/JF801905Y |
| 4H-1-Benzopyran-4-one, 7-(beta-D-glucopyranosyloxy)-3-(4-hydroxyphenyl)- | 4183640 | Click to see C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)OC4C(C(C(C(O4)CO)O)O)O)O | 416.40 | unknown |
https://doi.org/10.1002/JLAC.19314890110 https://doi.org/10.1080/00021369.1991.10870966 https://doi.org/10.1007/BF00580089 |
| 4H-1-Benzopyran-4-one,7-(b-D-glucopyranosyloxy)-3-(4-hydroxyphenyl)-6-methoxy- | 12004532 | Click to see | 446.40 | unknown | https://doi.org/10.1080/00021369.1991.10870966 |
| 6''-Malonyldaidzin | 14500869 | Click to see | 502.40 | unknown |
https://doi.org/10.1080/00021369.1991.10870966 https://doi.org/10.1021/JF801905Y |
| 6''-Malonylgenistin | 131750882 | Click to see | 518.40 | unknown |
https://doi.org/10.1080/00021369.1991.10870966 https://doi.org/10.1021/JF00044A017 https://doi.org/10.1021/JF00044A016 https://doi.org/10.1093/AJCN/68.6.1486S https://doi.org/10.1271/BBB1961.55.2227 https://doi.org/10.1021/JF801905Y https://doi.org/10.1248/BPB.22.1193 |
| 6''-O-Acetyldaidzin | 156155 | Click to see | 458.40 | unknown |
https://doi.org/10.1271/BBB1961.55.859 https://doi.org/10.1021/JF00044A017 https://doi.org/10.1021/JF00044A016 https://doi.org/10.1093/AJCN/68.6.1486S https://doi.org/10.1271/BBB1961.55.2227 https://doi.org/10.1002/PMIC.201700366 https://doi.org/10.1021/JF00063A016 https://doi.org/10.1248/BPB.22.1193 |
| 6''-O-Acetylgenistin | 5315831 | Click to see CC(=O)OCC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC=C(C3=O)C4=CC=C(C=C4)O)O)O)O)O | 474.40 | unknown |
https://doi.org/10.1271/BBB1961.55.859 https://doi.org/10.1021/JF00044A017 https://doi.org/10.1021/JF00044A016 https://doi.org/10.1093/AJCN/68.6.1486S https://doi.org/10.1271/BBB1961.55.2227 https://doi.org/10.1021/JF00063A016 https://doi.org/10.1248/BPB.22.1193 |
| 6''-O-Acetylglycitin | 10228095 | Click to see | 488.40 | unknown |
https://doi.org/10.1016/0731-7085(95)01619-8 https://doi.org/10.1080/00021369.1991.10870668 https://doi.org/10.1021/JF00044A017 https://doi.org/10.1248/BPB.22.1193 https://doi.org/10.1271/BBB1961.55.2227 https://doi.org/10.1021/JF00044A016 |
| 6''-O-Malonylglycitin | 23724657 | Click to see COC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=C(C=C3)O)OC4C(C(C(C(O4)COC(=O)CC(=O)O)O)O)O | 532.40 | unknown |
https://doi.org/10.1080/00021369.1991.10870966 https://doi.org/10.1021/JF00044A017 https://doi.org/10.1021/JF00044A016 https://doi.org/10.1016/0731-7085(95)01619-8 https://doi.org/10.1093/AJCN/68.6.1486S https://doi.org/10.1271/BBB1961.55.2227 https://doi.org/10.1093/AJCN/68.6.1480S https://doi.org/10.1021/JF801905Y https://doi.org/10.1248/BPB.22.1193 |
| Acetyl daidzin | 102028680 | Click to see COCC1C(C(C(C(O1)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=C(C=C4)O)O)O)O | 430.40 | unknown |
https://doi.org/10.1016/0731-7085(95)01619-8 https://doi.org/10.1093/AJCN/68.6.1474S |
| Acetylgenistin | 129650960 | Click to see CC(=O)C1=C(C(=O)C2=C(C=C(C=C2O1)OC3C(C(C(C(O3)CO)O)O)O)O)C4=CC=C(C=C4)O | 474.40 | unknown |
https://doi.org/10.1016/0731-7085(95)01619-8 https://doi.org/10.1093/AJCN/68.6.1474S |
| Daidzin | 107971 | Click to see | 416.40 | unknown |
https://doi.org/10.1271/BBB1961.55.859 https://doi.org/10.1016/S0731-7085(00)00264-8 https://doi.org/10.1021/NP010606G https://doi.org/10.1016/0031-9422(83)80013-2 https://doi.org/10.1016/S0021-9673(01)87656-1 https://doi.org/10.1021/JF00044A017 https://doi.org/10.1021/JF00044A016 https://doi.org/10.1007/BF00570693 https://doi.org/10.1021/NP980566P https://doi.org/10.1093/AJCN/68.6.1474S https://doi.org/10.1248/CPB.33.3834 https://doi.org/10.1021/JF00048A013 https://doi.org/10.1007/BF00580089 https://doi.org/10.1002/JLAC.19314890110 https://doi.org/10.1021/JF00035A027 https://doi.org/10.1021/JF00063A016 https://doi.org/10.1002/PMIC.201700366 https://doi.org/10.1021/JF00123A028 https://doi.org/10.1271/BBB1961.55.2227 https://doi.org/10.1080/00021369.1991.10870966 https://doi.org/10.1016/S0031-9422(00)82649-7 https://doi.org/10.1016/0731-7085(95)01619-8 https://doi.org/10.1248/BPB.22.1193 https://doi.org/10.1271/BBB.56.99 https://doi.org/10.1021/JF00110A035 https://doi.org/10.1093/AJCN/68.6.1480S https://doi.org/10.1093/AJCN/68.6.1486S |
| Dihydrodaidzin | 10341941 | Click to see | 418.40 | unknown | https://doi.org/10.1021/NP010606G |
| Dihydrogenistin | 11070108 | Click to see C1C(C(=O)C2=C(C=C(C=C2O1)OC3C(C(C(C(O3)CO)O)O)O)O)C4=CC=C(C=C4)O | 434.40 | unknown | https://doi.org/10.1021/NP010606G |
| Genistin | 5281377 | Click to see | 432.40 | unknown |
https://doi.org/10.1271/BBB1961.55.859 https://doi.org/10.1021/NP010606G https://doi.org/10.1016/0031-9422(83)80013-2 https://doi.org/10.1016/S0021-9673(01)87656-1 https://doi.org/10.1021/JF00044A017 https://doi.org/10.1021/JF00044A016 https://doi.org/10.1007/BF00570693 https://doi.org/10.1021/NP980566P https://doi.org/10.1093/AJCN/68.6.1474S https://doi.org/10.1248/CPB.33.3834 https://doi.org/10.1021/JF00048A013 https://doi.org/10.1007/BF00580089 https://doi.org/10.1055/S-2002-32545 https://doi.org/10.1021/JF00035A027 https://doi.org/10.1021/JF00063A016 https://doi.org/10.1021/JF00123A028 https://doi.org/10.1080/00021369.1991.10870966 https://doi.org/10.1016/S0031-9422(00)82649-7 https://doi.org/10.1021/JF801905Y https://doi.org/10.1016/0731-7085(95)01619-8 https://doi.org/10.1248/BPB.22.1193 https://doi.org/10.1021/JF00110A035 https://doi.org/10.1271/BBB.56.99 https://doi.org/10.1093/AJCN/68.6.1480S https://doi.org/10.1093/AJCN/68.6.1486S |
| Genistin 6''-O-acetate | 22288010 | Click to see CC(=O)OCC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC=C(C3=O)C4=CC=C(C=C4)O)O)O)O)O | 474.40 | unknown | via CMAUP database |
| Genistoside | 5284639 | Click to see C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)OC4C(C(C(C(O4)CO)O)O)O)O | 432.40 | unknown |
https://doi.org/10.1007/BF00580089 https://doi.org/10.1021/JF801905Y https://doi.org/10.1055/S-2002-32545 https://doi.org/10.1080/00021369.1991.10870966 |
| Glycitin | 187808 | Click to see | 446.40 | unknown |
https://doi.org/10.1093/AJCN/68.6.1480S https://doi.org/10.1093/AJCN/68.6.1486S https://doi.org/10.1080/00021369.1991.10870966 https://doi.org/10.1016/0731-7085(95)01619-8 https://doi.org/10.1271/BBB1961.55.2227 https://doi.org/10.1248/BPB.22.1193 https://doi.org/10.1021/NP010606G https://doi.org/10.1021/JF00044A017 https://doi.org/10.1021/JF00044A016 https://doi.org/10.1093/AJCN/68.6.1474S |
| Malonyldaidzin | 9913968 | Click to see C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)OC4C(C(C(C(O4)COC(=O)CC(=O)O)O)O)O)O | 502.40 | unknown |
https://doi.org/10.1080/00021369.1991.10870966 https://doi.org/10.1021/JF00044A017 https://doi.org/10.1021/JF00044A016 https://doi.org/10.1016/0731-7085(95)01619-8 https://doi.org/10.1093/AJCN/68.6.1486S https://doi.org/10.1271/BBB1961.55.2227 https://doi.org/10.1093/AJCN/68.6.1480S https://doi.org/10.1021/JF801905Y https://doi.org/10.1093/AJCN/68.6.1474S https://doi.org/10.1002/PMIC.201700366 https://doi.org/10.1248/BPB.22.1193 |
| Malonylgenistin | 15934091 | Click to see C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)OC4C(C(C(C(O4)COC(=O)CC(=O)O)O)O)O)O | 518.40 | unknown |
https://doi.org/10.1080/00021369.1991.10870966 https://doi.org/10.1016/0731-7085(95)01619-8 https://doi.org/10.1093/AJCN/68.6.1480S https://doi.org/10.1021/JF801905Y https://doi.org/10.1016/S0031-9422(03)00379-0 https://doi.org/10.1093/AJCN/68.6.1474S https://doi.org/10.1002/PMIC.201700366 |
| Npc198030 | 3733033 | Click to see | 430.40 | unknown | https://doi.org/10.1007/BF00580089 |
| Ononin | 442813 | Click to see | 430.40 | unknown |
https://doi.org/10.1007/BF00580089 https://doi.org/10.1016/0031-9422(83)80013-2 |
| > Phenylpropanoids and polyketides / Isoflavonoids / O-methylated isoflavonoids / 4-O-methylated isoflavonoids / 4-O-methylisoflavones | |||||
| Afromosin | 5281704 | Click to see | 298.29 | unknown | https://doi.org/10.1021/NP50048A030 |
| Biochanin A | 5280373 | Click to see | 284.26 | unknown |
https://doi.org/10.1021/NP010606G https://doi.org/10.1016/S0021-9673(97)00989-8 |
| biochanin A(1-) | 25203224 | Click to see | 283.25 | unknown | via CMAUP database |
| Formononetin | 5280378 | Click to see | 268.26 | unknown |
https://doi.org/10.1016/0031-9422(83)80013-2 https://doi.org/10.1007/BF00575726 https://doi.org/10.1021/NP980566P https://doi.org/10.1002/PMIC.201700366 |
| > Phenylpropanoids and polyketides / Linear 1,3-diarylpropanoids / Chalcones and dihydrochalcones / 2-Hydroxychalcones | |||||
| Isoliquiritigenin | 638278 | Click to see | 256.25 | unknown | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC195661/ |
| > Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins | |||||
| 2-[6-[[(1R,19R,21S,22R,23R)-6,7,8,11,12,13,22-heptahydroxy-3,16-dioxo-21-(3,4,5-trihydroxybenzoyl)oxy-2,17,20-trioxatetracyclo[17.3.1.04,9.010,15]tricosa-4,6,8,10,12,14-hexaen-23-yl]oxycarbonyl]-2,3,4-trihydroxyphenyl]-3,4,5-trihydroxybenzoic acid | 23258819 | Click to see | 954.70 | unknown | https://doi.org/10.1021/JO00275A026 |
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