Exact Mass: 210.1494
Exact Mass Matches: 210.1494
Found 500 metabolites which its exact mass value is equals to given mass value 210.1494,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Jasmonic acid
Jasmonic acid is an oxo monocarboxylic acid that is (3-oxocyclopentyl)acetic acid substituted by a (2Z)-pent-2-en-1-yl group at position 2 of the cyclopentane ring. It has a role as a plant metabolite and a member of jasmonates. It is a conjugate acid of a jasmonate(1-). It is an enantiomer of a (+)-jasmonic acid. Jasmonic acid is a natural product found in Ficus superba, Cleyera japonica, and other organisms with data available. Jasmonic acid is found in apple. Esters are present in Jasminum grandiflorum (royal jasmine) and are responsible for its odour. Jasmonic acid is a member of the jasmonate class of plant hormones. It is biosynthesized from linolenic acid by the octadecanoid pathway An oxo monocarboxylic acid that is (3-oxocyclopentyl)acetic acid substituted by a (2Z)-pent-2-en-1-yl group at position 2 of the cyclopentane ring. Esters are present in Jasminum grandiflorum (royal jasmine) and are responsible for its odour [DFC] D006133 - Growth Substances > D010937 - Plant Growth Regulators
7-Epijasmonic acid
7-epijasmonic acid, also known as (+)-epijasmonate, is a member of the class of compounds known as jasmonic acids. Jasmonic acids are lipids containing or derived from a jasmonic acid, with a structure characterized by the presence of an alkene chain linked to a 2-(3-oxocyclopentyl)acetic acid moiety. Thus, 7-epijasmonic acid is considered to be an octadecanoid lipid molecule. 7-epijasmonic acid is practically insoluble (in water) and a weakly acidic compound (based on its pKa). 7-epijasmonic acid can be found in a number of food items such as broad bean, flaxseed, corn, and eggplant, which makes 7-epijasmonic acid a potential biomarker for the consumption of these food products.
altretamine
C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents D009676 - Noxae > D000477 - Alkylating Agents D000970 - Antineoplastic Agents
4-(Butoxymethyl)-2-methoxyphenol
Vanillyl butyl ether is an ether of monohydroxybenzoic acid. It is added to food products as a flavoring agent. It is also present in cosmetics and personal care products as a fragrance ingredient, oral care agent, hair conditioning agent, and warming or cooling agent. 4-(Butoxymethyl)-2-methoxyphenol is a cooling agent used in confectionery etc. Cooling agent used in confectionery etc. Vanillyl butyl ether is a major contributor to the characteristic flavor and fragrance of vanilla. Vanillyl butyl ether is one of the eco-friendly and nontoxic substances. Vanillyl butyl ether has been proposed as a mild warming agent providing a warming sensation and enhancing the blood circulation[1].
L,L-Cyclo(leucylprolyl)
L,L-Cyclo(leucylprolyl) is found in alcoholic beverages. L,L-Cyclo(leucylprolyl) is produced by microorganisms and is a bitter component of sake and contributes to the flavour of beer. L,L-Cyclo(leucylprolyl), also known as cyclo(leu-pro) or cyclo(L-prolyl-L-leucyl), belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof. L,L-Cyclo(leucylprolyl) is a secondary metabolite. Secondary metabolites are metabolically or physiologically non-essential metabolites that may serve a role as defense or signalling molecules. In some cases they are simply molecules that arise from the incomplete metabolism of other secondary metabolites. Based on a literature review a significant number of articles have been published on L,L-Cyclo(leucylprolyl). L-Leucyl-L-proline lactam. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=2873-36-1 (retrieved 2024-07-10) (CAS RN: 2873-36-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0). Cyclo(L-Leu-L-Pro) is an inhibitory substance targeting to production of norsolorinic acid (NA，a precursor of aflatoxin)，which can be isolated from A. xylosoxidans NFRI-A1. Cyclo(L-Leu-L-Pro) inhibits accumulation of NA by A. parasiticus NFRI-95 and inhibits spore formation. Cyclo(L-Leu-L-Pro) inhibits aflatoxin production with an IC50 of 0.2 mg/mL in A. parasiticus SYS-4[1].
Isobornyl propionate
Isobornyl propionate is a flavouring agent. Flavouring agent
Neryl propionate
Geranyl propionate is found in citrus. Geranyl propionate is found in citrus peel oils, kumquat peel oil, muscadine grape (Vitis rotundifolia), hop oil and cardamon (Ellettaria cardamomum). Geranyl propionate is a flavouring agent. Found in citrus peel oils, kumquat peel oil, muscadine grape (Vitis rotundifolia), hop oil and cardamon (Ellettaria cardamomum). Flavouring agent
Artemisyl propionate
Artemisyl propionate is a constituent of Artemisia vulgaris (mugwort). Constituent of Artemisia vulgaris (mugwort)
(R)-8-Acetoxycarvotanacetone
(R)-8-Acetoxycarvotanacetone is found in herbs and spices. (R)-8-Acetoxycarvotanacetone is a constituent of cardamom oil. Constituent of cardamom oil. (R)-8-Acetoxycarvotanacetone is found in herbs and spices.
Sedanonic acid
Sedanonic acid is found in green vegetables. Sedanonic acid is isolated from celery oil (Apium graveolens) after hydrolysis. Isolated from celery oil (Apium graveolens) after hydrolysis Sedanonic acid is found in green vegetables.
Cepanone
Constituent of Allium cepa (shallot) flavour and other Allium subspecies Cepanone is found in garden onion and onion-family vegetables. Cepanone is found in garden onion. Cepanone is a constituent of Allium cepa (shallot) flavour and other Allium species
3-Ethenyl-2,5-dimethyl-4-oxohex-5-en-2-yl acetate
3-Ethenyl-2,5-dimethyl-4-oxohex-5-en-2-yl acetate is a constituent of Artemisia vulgaris (mugwort). Constituent of Artemisia vulgaris (mugwort)
Tsibulin 1
Phytoalexin from onion (Allium cepa) bulbs. Tsibulin 1 is found in garden onion and onion-family vegetables. Tsibulin 1 is found in onion-family vegetables. Phytoalexin from onion (Allium cepa) bulbs.
Methyl (2E,6Z)-dodecadienoate
Methyl (2E,6Z)-dodecadienoate is found in pomes. Methyl (2E,6Z)-dodecadienoate is a constituent of Bartlett pears Constituent of Bartlett pears. Methyl (2E,6Z)-dodecadienoate is found in pomes.
Altretamine
Altretamine is only found in individuals that have used or taken this drug. It is an alkylating agent proposed as an antineoplastic. It also acts as a chemosterilant for male houseflies and other insects. [PubChem]The precise mechanism by which altretamine exerts its cytotoxic effect is unknown although it is classified as an alkylating anti-neoplastic agent. Through this mechanism, the drug is metabolized into alkylating agents by N-demethylation. These alkylating species consequently damage tumor cells. C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents D009676 - Noxae > D000477 - Alkylating Agents D000970 - Antineoplastic Agents
Linalyl propionate
Linalyl propionate is found in ginger. Linalyl propionate is found in lavender and sage oils in an enantiomeric form. Linalyl propionate is used in perfumery and food flavourin Found in lavender and sage oils in an enantiomeric form. It is used in perfumery and food flavouring.
alpha-Terpineol propanoate
alpha-Terpineol propanoate is found in lemon. alpha-Terpineol propanoate is a flavouring agent Flavouring agent. alpha-Terpinyl propanoate is found in wild celery and lemon.
Dihydro-3-(2-octenyl)-2,5-furandione
Dihydro-3-(2-octenyl)-2,5-furandione is a reactant for manufacture of octenylsuccinoyl starches, which are used as emulsifiers in foods and pharmaceutical products. Reactant for manuf. of octenylsuccinoyl starches, which are used as emulsifiers in foods and pharmaceutical products.
1-Benzyloxy-1-(2-methoxyethoxy)ethane
1-Benzyloxy-1-(2-methoxyethoxy)ethane is a flavouring ingredient. Flavouring ingredient
Citral propylene glycol acetal
Citral propylene glycol acetal is a flavouring ingredient. Flavouring ingredient
Propyl 2,4-decadienoate
Propyl 2,4-decadienoate is a flavouring ingredient with a Bartlett pear flavour. Flavouring ingredient with a Bartlett pear flavour
Isoamyl 2-furonpropionate
Isoamyl 2-furonpropionate is a flavouring ingredient. Flavouring ingredient
Dihydro-3-(1-octenyl)-2,5-furandione
Starch modifier (esterification agent) for use in beverages and beverage bases as a stabiliser or emulsifier. Starch modifier (esterification agent) for use in beverages and beverage bases as a stabiliser or emulsifier
2-Propenyl cyclohexanebutanoate
2-Propenyl cyclohexanebutanoate is a flavouring ingredient. Flavouring ingredient
Octahydro-2,5,5,8a-tetramethyl-7H-1-benzopyran-7-one
Octahydro-2,5,5,8a-tetramethyl-7H-1-benzopyran-7-one is found in fruits. Octahydro-2,5,5,8a-tetramethyl-7H-1-benzopyran-7-one is a constituent of dried kukoshi berries (Lycium chinense) and tobacco oil. Constituent of dried kukoshi berries (Lycium chinense) and tobacco oil. Octahydro-2,5,5,8a-tetramethyl-7H-1-benzopyran-7-one is found in fruits.
(+/-)-trans- and cis-4,8-Dimethyl-3,7-nonadien-2-yl acetate
It is used as a food additive .
2,6,6-trimethyl-4-oxo-2-cyclohexene-1-acetic acid methyl ester
(+)-Dictyoprolen|(+)-dictyoprolene|(S)-dictyoprolene|Dictyoprolene
N-(Hexahydro-1H-pyrrolizin-2-yl)-2-methylbutanamide
N-(2-Methylbutanoyl)hexahydro-1H-pyrrolizine-1-amine
cis-3-isobutyl-tetrahydroimidazo[1,2-a]pyridine-2,5-dione
(Z)-1,7-Hexadecadiene-10,12,14-triyne|1,7Z-hexadecadien-10,12,14-triine|hexadeca-1,7c-diene-10,12,14-triyne
4-oxogeranyl acetate|Ac-(E)-1-Hydroxy-3,7-dimethyl-2,6-octadien-4-one
1beta,4beta-dihydroxy-11,12,13-trinor-8,9-eudesmen-7-one
1-(7,7-dimethyl-1,3,4,5,6,7-hexahydro-isobenzofuran-1-yl)-propan-2-ol
4-(3-Hydroxybutyl)-3,5,5-trimethylcyclohex-2-en-1-one
3,11-Dioxatricyclo[5.4.0.0(2,4)]undecane, 1,6,6,10-tetramethyl-, (1R,2R,4R,7R,10S)-
(5R,6S)-6-[(2E)-but-2-en-2-yl]-3,3,5-trimethyltdihydro-2H-pyran-2,4(3H)-dione|helicascolide C
2,5-dimethyl-5-vinylhexahydro-2,2-bifuran-5(2h)-one
1-(1-Hydroxy-5,5,8-trimethyl-bicyclo[2.2.2]oct-2-yl)-aethanon|1-(1-hydroxy-5,5,8-trimethyl-bicyclo[2.2.2]oct-2-yl)-ethanone
(1S:2Xi)-3-Oxo-2,4,7,7-tetramethyl-norbornan-carbonsaeure-(2)|(1S:2Xi)-3-oxo-2,4,7,7-tetramethyl-norbornane-carboxylic acid-(2)
(3R*,4R*,6S*)-3-acetoxy-6-hydroxy-p-mentha-1,8-diene
(1S,7R)-4-oxa-7,11,11-trimethylbicyclo<5.4.0>undecan-3-one|(1S,7R)-4-oxa-7,11,11-trimethylbicyclo[5.4.0]undecan-3-one
Jasmonic acid
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.911 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.912 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.909 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.910
3-(2-methylpropyl)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
3-butan-2-yl-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
3-(2-methylpropyl)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione
Cyclo(pro-leu)
Cyclo(L-Leu-L-Pro) is an inhibitory substance targeting to production of norsolorinic acid (NA，a precursor of aflatoxin)，which can be isolated from A. xylosoxidans NFRI-A1. Cyclo(L-Leu-L-Pro) inhibits accumulation of NA by A. parasiticus NFRI-95 and inhibits spore formation. Cyclo(L-Leu-L-Pro) inhibits aflatoxin production with an IC50 of 0.2 mg/mL in A. parasiticus SYS-4[1].
Cyclo(-leu-pro)
Production by microorganisms. Bitter component of sake and contributes to the flavour of beer. L,L-Cyclo(leucylprolyl) is found in alcoholic beverages. Cyclo(L-Leu-L-Pro) is an inhibitory substance targeting to production of norsolorinic acid (NA，a precursor of aflatoxin)，which can be isolated from A. xylosoxidans NFRI-A1. Cyclo(L-Leu-L-Pro) inhibits accumulation of NA by A. parasiticus NFRI-95 and inhibits spore formation. Cyclo(L-Leu-L-Pro) inhibits aflatoxin production with an IC50 of 0.2 mg/mL in A. parasiticus SYS-4[1].
(±)-Jasmonic acid
Gancidin W
Cyclo(L-Leu-L-Pro) is an inhibitory substance targeting to production of norsolorinic acid (NA，a precursor of aflatoxin)，which can be isolated from A. xylosoxidans NFRI-A1. Cyclo(L-Leu-L-Pro) inhibits accumulation of NA by A. parasiticus NFRI-95 and inhibits spore formation. Cyclo(L-Leu-L-Pro) inhibits aflatoxin production with an IC50 of 0.2 mg/mL in A. parasiticus SYS-4[1].
Butyl vanillyl ether
Vanillyl butyl ether is a major contributor to the characteristic flavor and fragrance of vanilla. Vanillyl butyl ether is one of the eco-friendly and nontoxic substances. Vanillyl butyl ether has been proposed as a mild warming agent providing a warming sensation and enhancing the blood circulation[1].
Ieodomycin B
A natural product found in Bacillus species.
2-METHYL-2-PROPANYL 3,4,5,6-TETRAHYDROPYRROLO[3,4-C]PYRROLE-2(1H)-CARBOXYLATE
(S)-TERT-BUTYL 2-(CYANOMETHYL)PYRROLIDINE-1-CARBOXYLATE
N-methyl-{[5-(morpholinomethyl)-2-furyl]methyl}amine
(3,3-DIMETHOXY-PROPYL)-(4-METHYL-PYRIDIN-2-YL)-AMINE
4-(4-Hydroxy-4-methylpentyl)cyclohex-3-enecarbaldehyde
(R)-TERT-BUTYL 2-(CYANOMETHYL)PYRROLIDINE-1-CARBOXYLATE
3-(4-hydroxy-4-methylpentyl)cyclohex-3-ene-1-carbaldehyde
(S)-2,2,4,6,6-PENTAMETHYL-7,7A-DIHYDROBENZO[D][1,3]DIOXOL-5(6H)-ONE
1-ethyl-3-propyl-1h-pyrazole-5-carboxylic acid ethyl ester
Bicyclo[2.2.1]heptane-1-carboxylic acid, 3-hydrazono-4,7,7-trimethyl- (9CI)
2-(5,6-dihydro-2H-pyran-3-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
2-Cyclohexene-1-carboxylicacid, 6-ethyl-2-methyl-4-oxo-, ethyl ester
5-TERT-BUTYL-2-(3-METHYL-BUTYL)-2,4-DIHYDRO-PYRAZOL-3-ONE
2,8-Diazaspiro[4.5]decane-1,3-dione,2-ethyl-8-methyl-
(S)-3-CYANOMETHYL-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
2-(3,4-Dihydro-2H-pyran-6-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Ethyl 3-(Tert-Butyl)-1-Methyl-1h-Pyrazole-5-Carboxylate
(R)-TERT-BUTYL 3-(CYANOMETHYL)PYRROLIDINE-1-CARBOXYLATE
1H-Pyrrole-2-carboxylicacid,3-amino-5-(1,1-dimethylethyl)-,ethylester(9CI)
1,3-Benzodioxol-5(6H)-one, 7,7a-dihydro-2,2,4,6,6-pentamethyl-
(1R,4R)-N1-(5-Fluoro-pyriMidin-2-yl)-cyclohexane-1,4-diaMine
1-METHYL-3-(2-METHYLPROPYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID ETHYL ESTER
2-(3,4-Dihydro-2H-pyran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
7,7,9-TRIMETHYL-1,3-DIAZA-SPIRO[4.5]DECANE-2,4-DIONE
2-Cyclohexene-1-carboxylicacid, 3-ethyl-2-methyl-4-oxo-, ethyl ester
1-(1H-INDOL-3-YLMETHYL)-PIPERIDINE-4-CARBOXYLICACID
(2E,6E)-3,7-Dimethyl-8-oxoocta-2,6-dien-1-YL acetate
(3E,5E)-tridecadienoic acid
A tridecadienoic acid with double bonds at positions 3 and 5 (both E isomer).
(1E,3S,4Z)-7-amino-1-{3-[(1E)-prop-1-en-1-yl]oxiran-2-yl}hepta-1,4-dien-3-ol
[(1S,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] propanoate
Methyl 3,4,4abeta,5,6,7,8,8abeta-octahydronaphthalen-1(2H)-oxo-4alpha-carboxylate
3-Dimethylaminomethyl-4-(1-pyrrolidinyl)-2(5H)-furanone
Methyl 4,4-dimethyl-8-oxo-1alpha,5alpha-bicyclo(3.3.0)octane-2alpha-carboxylate
Methyl 4,4-dimethyl-8-oxo-1alpha,5alpha-bicyclo(3.3.0)octane-2beta-carboxylate
1-(Tetrahydro-2H-pyran-4-yl)-3-cyclohexene-1-carboxylic acid
2,6-Dimethyl-6-(1,3-dioxolan-2-yl)-1-cyclohexene-1-carbaldehyde
Methyl 4(3H)-oxo-1,2,4aalpha,5,6,7,8,8abeta-octahydronaphthalene-1beta-carboxylate
Cyclo(L-leu-L-pro)
A homodetic cyclic peptide composed from leucyl and prolyl residues.
(+)-7-Isojasmonic acid
An oxylipin that is [(1S)-3-oxocyclopentyl]acetic acid substituted by a (2Z)-pent-2-en-1-yl group at position 2 on the cyclopentanone ring.
Octahydro-2,5,5,8a-tetramethyl-7H-1-benzopyran-7-one
Cyclo(D-Leu-D-Pro)
Cyclo(D-Leu-D-Pro) is a polypeptide that can be found by peptide screening. Peptide screening is a research tool that pools active peptides primarily by immunoassay. Peptide screening can be used for protein interaction, functional analysis, epitope screening, especially in the field of agent research and development[1].
4-[(2,3-dimethyloxiran-2-yl)methyl]-3-propyl-5h-furan-2-one
(4s)-4-[(3s)-3-hydroxybutyl]-3,5,5-trimethylcyclohex-2-en-1-one
5-[(1e)-4-hydroxy-4-methylhexa-1,5-dien-1-yl]-5-methyloxolan-2-one
2-(2-formyl-3-methylcyclopentyl)prop-1-en-1-yl acetate
(5s,6r)-6-(but-2-en-2-yl)-3,3,5-trimethyloxane-2,4-dione
(3e)-4-[(1r,4s,6s)-4-hydroxy-2,2-dimethyl-7-oxabicyclo[4.1.0]heptan-1-yl]but-3-en-2-one
4-methoxy-5-methyl-6-[(2r)-pentan-2-yl]pyran-2-one
(5s)-5-methyl-3-[(5s)-5-methylheptyl]-5h-furan-2-one
(5s)-5-[(2e,5s)-5-hydroxy-5-methylhepta-2,6-dien-2-yl]oxolan-2-one
(4s)-3,3,6-trimethylhepta-1,5-dien-4-yl propanoate
(1r,4as,7r,7ar)-4,7-dimethyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-1-yl acetate
1-hydroxy-3-(2-methylpropyl)-3h,6h,7h,8h,8ah-pyrrolo[1,2-a]pyrazin-4-one
(1r,2s,4r)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl propanoate
(3e)-4-[(1s,4s,6r)-4-hydroxy-2,2,6-trimethylcyclohexyl]but-3-en-2-one
2,9-dimethyltricyclo[5.4.0.0²,⁹]undecane-8,11-diol
7-hydroxy-1-(3-methylbut-2-en-1-yl)-3-oxabicyclo[3.2.1]octan-2-one
(1r,2r,5s,6s,7r)-2-hydroxy-5,6-dimethyl-9-oxatricyclo[5.2.2.0¹,⁶]undecan-8-one
10-oxo-isodam-3-en-15-ol
{"Ingredient_id": "HBIN000189","Ingredient_name": "10-oxo-isodam-3-en-15-ol","Alias": "NA","Ingredient_formula": "C13H22O2","Ingredient_Smile": "CC1=C(C(CCC1=O)(C)C)CCC(C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40313","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1,7-hexadecadiene-10,12,14-triyne
{"Ingredient_id": "HBIN002047","Ingredient_name": "1,7-hexadecadiene-10,12,14-triyne","Alias": "NA","Ingredient_formula": "C16H18","Ingredient_Smile": "CC#CC#CC#CCC=CCCCCC=C","Ingredient_weight": "210.31","OB_score": "NA","CAS_id": "56319-22-3","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9471","PubChem_id": "13964095","DrugBank_id": "NA"}
3,4-diethylbiphenyl
{"Ingredient_id": "HBIN007342","Ingredient_name": "3,4-diethylbiphenyl","Alias": "NA","Ingredient_formula": "C16H18","Ingredient_Smile": "CCC1=C(C=C(C=C1)C2=CC=CC=C2)CC","Ingredient_weight": "210.31 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40608","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "43551","DrugBank_id": "NA"}
3-hydroxymegastigm-5-en-9-one
{"Ingredient_id": "HBIN008722","Ingredient_name": "3-hydroxymegastigm-5-en-9-one","Alias": "NA","Ingredient_formula": "C13H22O2","Ingredient_Smile": "CC1=C(C(CC(C1)O)(C)C)CCC(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10371","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(3r,6r,7 e,9r)-3,9-dihydroxy-4,7-megastigma-diene
{"Ingredient_id": "HBIN009560","Ingredient_name": "(3r,6r,7 e,9r)-3,9-dihydroxy-4,7-megastigma-diene","Alias": "NA","Ingredient_formula": "C13H22O2","Ingredient_Smile": "CC1=CC(CC(C1C=CC(C)O)(C)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5955","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(3s,7 e,9r)-3,9-dihydroxy-5,7-megastigmadiene
{"Ingredient_id": "HBIN009694","Ingredient_name": "(3s,7 e,9r)-3,9-dihydroxy-5,7-megastigmadiene","Alias": "NA","Ingredient_formula": "C13H22O2","Ingredient_Smile": "CC1=CC(CC(C1C=CC(C)O)(C)C)O","Ingredient_weight": "210.31 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5956","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101338767","DrugBank_id": "NA"}
(4aR,7R,8R)-7,8-dihydroxy-4a,8-dimethyl-4,5,6,7-tetrahydro-3H-naphthalen-2-one
{"Ingredient_id": "HBIN010233","Ingredient_name": "(4aR,7R,8R)-7,8-dihydroxy-4a,8-dimethyl-4,5,6,7-tetrahydro-3H-naphthalen-2-one","Alias": "NA","Ingredient_formula": "C12H18O3","Ingredient_Smile": "NA","Ingredient_weight": "210.27","OB_score": "45.17207078","CAS_id": "363610-34-8","SymMap_id": "SMIT10492","TCMID_id": "NA","TCMSP_id": "MOL009349","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(6r,9r)-9-hydroxy-4-megastigmen-3-one
{"Ingredient_id": "HBIN012786","Ingredient_name": "(6r,9r)-9-hydroxy-4-megastigmen-3-one","Alias": "NA","Ingredient_formula": "C13H22O2","Ingredient_Smile": "CC1=CC(=O)CC(C1CCC(C)O)(C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10370","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
