Exact Mass: 216.0758
Exact Mass Matches: 216.0758
Found 500 metabolites which its exact mass value is equals to given mass value 216.0758
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Nepodin
Nepodin is a member of naphthols. Nepodin is a natural product found in Rumex dentatus, Rumex alpinus, and other organisms with data available. Nepodin (Musizin) is a quinone oxidoreductase (PfNDH2) inhibitor isolate from Rumex crispus[1].Nepodin (Musizin) stimulates the translocation of GLUT4 to the plasma membrane by activation of AMPK[2].Nepodin (Musizin) has antidiabetic and antimalarial activities. Nepodin (Musizin) is a quinone oxidoreductase (PfNDH2) inhibitor isolate from Rumex crispus[1].Nepodin (Musizin) stimulates the translocation of GLUT4 to the plasma membrane by activation of AMPK[2].Nepodin (Musizin) has antidiabetic and antimalarial activities. Nepodin (Musizin) is a quinone oxidoreductase (PfNDH2) inhibitor isolate from Rumex crispus[1].Nepodin (Musizin) stimulates the translocation of GLUT4 to the plasma membrane by activation of AMPK[2].Nepodin (Musizin) has antidiabetic and antimalarial activities.
TERBACIL
CONFIDENCE standard compound; INTERNAL_ID 1347; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4035; ORIGINAL_PRECURSOR_SCAN_NO 4030 CONFIDENCE standard compound; INTERNAL_ID 1347; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4010; ORIGINAL_PRECURSOR_SCAN_NO 4007 CONFIDENCE standard compound; INTERNAL_ID 1347; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3993; ORIGINAL_PRECURSOR_SCAN_NO 3990 CONFIDENCE standard compound; INTERNAL_ID 1347; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4017; ORIGINAL_PRECURSOR_SCAN_NO 4012 CONFIDENCE standard compound; INTERNAL_ID 1347; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4003; ORIGINAL_PRECURSOR_SCAN_NO 3999 CONFIDENCE standard compound; INTERNAL_ID 1347; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4025; ORIGINAL_PRECURSOR_SCAN_NO 4024 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3179
4,4-Thiodianiline
CONFIDENCE standard compound; INTERNAL_ID 936; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6420; ORIGINAL_PRECURSOR_SCAN_NO 6417 CONFIDENCE standard compound; INTERNAL_ID 936; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6456; ORIGINAL_PRECURSOR_SCAN_NO 6453 CONFIDENCE standard compound; INTERNAL_ID 936; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6267; ORIGINAL_PRECURSOR_SCAN_NO 6266 CONFIDENCE standard compound; INTERNAL_ID 936; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6445; ORIGINAL_PRECURSOR_SCAN_NO 6442 CONFIDENCE standard compound; INTERNAL_ID 936; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6454; ORIGINAL_PRECURSOR_SCAN_NO 6452 CONFIDENCE standard compound; INTERNAL_ID 936; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6453; ORIGINAL_PRECURSOR_SCAN_NO 6451 CONFIDENCE standard compound; INTERNAL_ID 8111 CONFIDENCE standard compound; INTERNAL_ID 2429 CONFIDENCE standard compound; INTERNAL_ID 4143
3-methoxy-5-methyl-1-naphthoic acid
A naphthoic acid that is 1-naphthoic acid carrying additional methoxy and methyl substituents at positions 3 and 5 respectively.
O-Desmethylnaproxen
O-Desmethylnaproxen is only found in individuals that have used or taken Naproxen. O-Desmethylnaproxen is a metabolite of Naproxen. O-desmethylnaproxen belongs to the family of Phenylacetic Acid Derivatives. These are compounds containing a phenylacetic acid moiety, which consists of a phenyl group substituted at the second position by an acetic acid.
L-1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid
L-1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid is found in garden tomato (var.). L-1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid is widespread in many foodstuffs especially fruit juices, jams and fermented foods or beverages. L-1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid is formed by Pictet-Spengler condensation of L-tryptophan and formaldehyde in nature or during food processin Widespread in many foodstuffs especially fruit juices, jams and fermented foods or beverages. Formed by Pictet-Spengler condensation of L-tryptophan and formaldehyde in nature or during food processing. L-1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid is found in garden tomato (variety).
Artemidinol
Artemidinol is found in herbs and spices. Artemidinol is a constituent of Artemisia dracunculus (tarragon)
(Z)-6-(2-Methoxyvinyl)-7-methyl-2H-1-benzopyran-2-one
(Z)-6-(2-Methoxyvinyl)-7-methyl-2H-1-benzopyran-2-one is found in fruits. (Z)-6-(2-Methoxyvinyl)-7-methyl-2H-1-benzopyran-2-one is a constituent of Ficus carica (fig)
6-(3,4-Methylenedioxyphenyl)-3,5-hexadien-2-one
6-(3,4-Methylenedioxyphenyl)-3,5-hexadien-2-one is found in beverages. 6-(3,4-Methylenedioxyphenyl)-3,5-hexadien-2-one is found in kava (Piper methysticum). FDA advises against use of kava in food due to potential risk of severe liver damage (2002
2-Phenylethyl 2-furancarboxylate
2-Phenylethyl 2-furancarboxylate is a flavouring ingredient. Flavouring ingredient
Ethyl 2-phenyl-3-furancarboxylate
Ethyl 2-phenyl-3-furancarboxylate is a flavouring ingredient. Flavouring ingredient
7-Methoxy-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one
Tazolol
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist
Mansouramycin A
A member of the class of isoquinolines that is 5,8-dihydroisoquinoline substituted by methyl, methyl, oxo, methylamino and oxo groups at positions 3, 4, 5, 7 and 8, respectively. It was isolated from Streptomyces Sp. strain Mei37 from North Sea coast, Germany.
Euparin
Euparin is a member of benzofurans. It has a role as a metabolite. Euparin is a natural product found in Eupatorium cannabinum, Liatris acidota, and other organisms with data available. A natural product found in Eupatorium cannabinum subspecies asiaticum.
3-Ethyl-4-(methoxyamino)-2,5-dioxoimidazolidine-4-carboxamide
2,3-Dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11ah)-dione
4-Hydroxymethyl-1-azulenecarboxylic acid methyl ester
(3E,11E)-tridecadiene-6,8,10-triyne-1,2,13-triol|trans,trans-Tridecadien-(2,10)-triin-(4,6,8)-triol-(1,12,13)|trideca-3t,11t-diene-5,7,9-triyne-1,2,13-triol
6-acetoxy-4,5-dihydroxy-2-hydroxymethylcyclohex-2-enone
cis-trans-9-(Thienyl-(2))-nona-4,6-dien-8-in-3-on|cis-trans-9--nona-4,6-dien-8-in-3-on
Noraucuparin
Noraucuparin is a natural product found in Berberis koreana with data available.
2-(Acetoxymethyl)-4,5,6-trihydroxy-2-cyclohexene-1-one
(2E)-3-[4-(buta-2,3-dienyl-1-oxy)-phenyl]prop-2-enoic acid|but-2,3-dienyl ether of p-hydroxycinnamic acid
Caerulomycin F
A pyridine alkaloid that is 2,2-bipyridine substituted at position 6 by a hydroxymethyl group and at position 4 by a methoxy group. Isolated from the marine-derived actinomycete Actinoalloteichus cyanogriseus, it exhibits antineoplastic activity.
cis- and trans-2--5-<4-hydroxybut-1-ynyl>-thiophene
1-[2-(1-Methylene-2-hydroxyethyl)benzofuran-5-yl]ethanone
1,2,3,4-Tetrahydro-5-methoxy-1-oxo-beta-carboline|5-Methoxy-1-oxo-1,2,3,4-tetrahydro-beta-carbolin|5-methoxy-1-oxo-1,2,3,4-tetrahydro-beta-carboline|5-methoxy-1-oxo-tetrahydro-beta-carboline|5-Methoxy-2,3,4,9-tetrahydro-beta-carbolin-1-on|5-methoxy-2,3,4,9-tetrahydro-beta-carbolin-1-one
3-(Acetoxymethyl)-4,5,6-trihydroxy-2-cyclohexene-1-one
1,2,3,9-tetrahydropyrrolo(2,1-b)quinazolin-1-carboxylic acid
2,3-dihydroxy-5-methoxybiphenyl
A natural product found in Rhaphiolepis indica var. tashiroi.
(+)-(2S,3S)-2,3-di-O-acetyl-2-C-methyl-D-erythrono-1,4-lactone|2,3-di-O-acetyl-2-C-methylerythrono-1,4-lactone
4-Formyl-antipyrine
CONFIDENCE standard compound; INTERNAL_ID 2667 CONFIDENCE standard compound; INTERNAL_ID 4107
1,2,3,4-Tetrahydro-6-Methoxy-1-oxo-beta-carboline
2,3-Dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione
cycloanthranilylproline
Organic chemicals, Polycyclic compounds, Anthracenes
Cymoxanil-TP IN-KQ960
CONFIDENCE standard compound; UCHEM_ID 4210
6-[(Z)-2-methoxyethenyl]-7-methyl-2H-chromen-2-one
1-BENZYL-1H-PYRAZOLE-4-CARBOXYLIC ACID METHYL ESTER
5-methyl-2-(2-methylphenyl)-1H-imidazole-4-carboxylic acid
3,5-dimethyl-1-phenyl-1H-pyrazole-4-carboxylic acid
3-Methoxy-4-(4-methyl-1H-imidazol-1-yl)benzaldehyde
(S)-(+)-2,3-DIHYDRO-1H-PYRROLO[2,1-C][1,4]BENZODIAZEPINE-5,11(10H,11AH)-DIONE
6-Methoxy-2,3,4,9-tetrahydro-1H-beta-carbolin-1-one
2-Naphthalenecarboxylic acid, 4-hydroxy-6-Methyl-, Methyl ester
4-Fluoro-4-hydroxybenzophenone
A member of the class of benzophenones that is phenol substituted by a 4-fluorobenzoyl group at position 4.
(S)-4-(2-METHYLBUTYL)[1,1-BIPHENYL]-4-CARBONITRILE
Urea, N-(2-fluoroethyl)-N-(1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)- (9CI)
ethyl 5-amino-3-(2-hydroxyethoxy)-1,2-oxazole-4-carboxylate
1-(4-METHOXYPHENYL)-5-METHYL-1H-PYRAZOLE-4-CARBALDEHYDE
5-methyl-1-(2-methylphenyl)pyrazole-4-carboxylic acid
1-(4-FLUORO-PHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBALDEHYDE
4-(Pyridin-4-yl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
2,3,4,9-Tetrahydro-1H-beta-carboline-3-carboxylic acid
Ethyl 1-methyl-3-ethyl-4-chloro-5-pyrazolecarboxylate
3-METHYL-5-PHENYL-1H-PYRAZOLE-4-CARBOXYLIC ACID METHYL ESTER
5-Amino-1-(2-fluorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile
4-[(Dimethylamino)methylene]-2-phenyl-1,3-oxazol-5(4H)-one
4-[[3-(chloromethyl)-1,2-oxazol-5-yl]methyl]morpholine
4-chloro-1-methyl-3-(2-methylpropyl)-1h-pyrazole-5-carboxylic acid
D-1,2,3,4-Tetrahydronorharman-3-carboxylic acid
1-METHYL-5-(P-TOLYL)-1H-PYRAZOLE-3-CARBOXYLIC ACID
(4,6-DICHLORO-2-(METHYLTHIO)PYRIMIDIN-5-YL)METHANAMINE
2-PHENYL-4,5,6,7-TETRAHYDROTHIAZOLO[5,4-C]PYRIDINE
3-FURANCARBOXYLIC ACID, 2-METHYL-5-(4-METHYLPHENYL)-
2-(Trimethylsilyl)furo[3,2-b]pyridine-6-carbonitrile
(1alpha,2alpha,4alpha)-1,2,4-Cyclohexanetricarboxylic Acid
5-Amino-1-(4-fluorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile
3-(2-OXO-2-PHENYLETHYL)-5,6-DIHYDROPYRAZIN-2(1H)-ONE
2,3,4,9-TETRAHYDRO-1H-PYRIDO[3,4-B]INDOLE-1-CARBOXYLIC ACID
1,2,3,4-Tetrahydro-β-carboline-1-carboxylic acid is a chemical used on the study of neurodegenerative diseases[1].
(S)-2-(2-BROMOPHENYL)-4-ISOPROPYL-4,5-DIHYDROOXAZOLE
(S)-3-AMINO-3-(3,4-METHYLENEDIOXYPHENYL)PROPIONICACID
2H-1-Benzopyran-2-one,4-methyl-7-(2-propen-1-yloxy)-
1H-Imidazole-5-carboxylicacid, 1-(phenylmethyl)-, methyl ester
Ethanone, 2,2,2-trifluoro-1-(2,4,5-trimethylphenyl)- (9CI)
C-(1-METHYL-1,2,3,4-TETRAHYDRO-QUINOLIN-6-YL)-METHYLAMINE
8-METHOXY-2,3-DIHYDROCYCLOPENTA[C]CHROMEN-4(1H)-ONE
3-Amino-2-hydroxy-N,N-dimethylbenzamide hydrochloride
5-METHYL-2-PHENYL-3H-IMIDAZOLE-4-CARBOXYLIC ACID METHYL ESTER
Methyl 1-allyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylate
Benzene,1,1-[(1E)-1,2-difluoro-1,2-ethenediyl]bis-
2-Naphthalenecarboxylicacid, 3-methoxy-, methyl ester
3-Piperidinecarboxylic acid,1-(aminothioxomethyl)-,ethyl ester
Ethanone, 2,2,2-trifluoro-1-[4-(1-methylethyl)phenyl]- (9CI)
N,N-Dimethyl-1-(morpholin-2-yl)methanamine dihydrochloride
Lithium (1,2-ethanediolato-O)bis[1,2-ethanediolato(2-)-O,O]silicate
3-(2,4-dimethylphenyl)-1H-pyrazole-4-carboxylic acid
3-(2,4-DIMETHYLPHENYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID
4-CHLORO-1-ETHYL-3-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID ETHYL ESTER
FURAN-2-CARBOXYLIC ACID (5-AMINO-2-METHYL-PHENYL)-AMINO
tert-Butyl 4-(chloromethyl)imidazole-1-carboxylate
Piperazine,1-(4-fluorophenyl)-, hydrochloride (1:1)
3-Phosphorincarbonitrile,4-amino-1,2,5,6-tetrahydro-1-phenyl-
Carbamic acid, (3-isothiocyanatopropyl)-, 1,1-dimethylethyl ester (9CI)
2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole-8-carboxylic acid
5-(4-METHYLPHENYL)FURAN-2-CARBOXYLIC ACID METHYL ESTER
1-phenyl-1H-Imidazole-2-carboxylic acid ethyl ester
1H-Imidazole-5-carboxylicacid,4-methyl-1-(phenylmethyl)-(9CI)
Pyridinium, 1-(4-sulfobutyl)-, 4-methylbenzenesulfonate
2-Naphthalenecarboxylic acid, 4-Methoxy-, Methyl ester
2,6-Diamino-1,7-Dihydro-8h-Imidazo[4,5-G]quinazolin-8-One
N(3)-(4-Methoxyfumaroyl)-2,3-diaminopropionic acid
A monocarboxylic acid amide obtained by the formal condensation of the terminal amino group of 3-amino-L-alanine with the carboxy group of (2E)-4-methoxy-4-oxobut-2-enoic acid.
(R)-(+)-1-(1-Phenylethyl)-1H-imidazole-5-carboxylic acid
N3-(4-methoxyfumaroyl)-L-2,3-diaminopropanoic acid
(R)-3-(indol-3-yl)-2-oxobutyrate
A 2-oxo monocarboxylic acid anion that is the conjugate base of (R)-3-(indol-3-yl)-2-oxobutyric acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.
5-Amino-1-[(4-fluorophenyl)methyl]imidazole-4-carbonitrile
2-[(Z)-hydroxyiminomethyl]-5,7-dimethylquinolin-8-ol
(2S)-2-[(E)-(acetylhydrazinylidene)methyl]pentanedioic acid
(E)-3-[(2S)-2-methyl-2H-chromen-3-yl]prop-2-enoic acid
2,3-Dihydro-1H,9H-3a,9a-methanocyclopenta[b][1]benzothiopyran-9-one
1,2,3,4-Tetrahydro-beta-carboline-3-carboxylic acid
A member of the class of beta-carbolines that is 1,2,3,4-tetrahydro-beta-carboline substituted at position 3 by a carboxy group.
(Z)-6-(2-Methoxyvinyl)-7-methyl-2H-1-benzopyran-2-one
Desmethylnaproxen
A member of the class of naphthols that is naproxen in which the 6-methoxy group has been demethylated.
(6-methoxy-2-naphthyl)acetic acid
A monocarboxylic acid consisting of 2-naphthylacetic acid having a methoxy substituent at the 6-position. The active metabolite of the prodrug nabumetone.
3-[4-(buta-2,3-dien-1-yloxy)phenyl]prop-2-enoic acid
(6r)-6-[(2r,3r)-3-phenyloxiran-2-yl]-5,6-dihydropyran-2-one
(2e)-3-[4-(buta-2,3-dien-1-yloxy)phenyl]prop-2-enoic acid
(6r)-6-[(2s,3r)-3-phenyloxiran-2-yl]-5,6-dihydropyran-2-one
8-hydroxy-3,9-diazatricyclo[8.4.0.0³,⁷]tetradeca-1(14),8,10,12-tetraen-2-one
3-methyl-5-(prop-1-en-2-yl)-1-benzofuran-7-carboxylic acid
4-{5-[(3e)-pent-3-en-1-yn-1-yl]thiophen-2-yl}but-3-yn-1-ol
3,7-dimethyl-2,6-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),3,5(13),9-tetraen-11-one
3-methyl-2-oxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),5(13),6,8,10-pentaene-4,7-diol
2,3,4,9-tetrahydro-pyrido-1H--(3,4b)- indole-3-carboxylic acid
{"Ingredient_id": "HBIN003866","Ingredient_name": "2,3,4,9-tetrahydro-pyrido-1H--(3,4b)- indole-3-carboxylic acid","Alias": "NA","Ingredient_formula": "C12H12N2O2","Ingredient_Smile": "C1C(NCC2=C1C3=CC=CC=C3N2)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42106","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3,4-epoxy-2-(2,4-hexadiynylidene)-1,6-dioxaspiro[4.4]nonane
{"Ingredient_id": "HBIN007471","Ingredient_name": "3,4-epoxy-2-(2,4-hexadiynylidene)-1,6-dioxaspiro[4.4]nonane","Alias": "NA","Ingredient_formula": "C13H12O3","Ingredient_Smile": "NA","Ingredient_weight": "216.236","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8273","PubChem_id": "NA","DrugBank_id": "NA"}
(-)-(3S)-1,2,3,4-tetrahydro-β-carboline-3-carboxylic acid
{"Ingredient_id": "HBIN009593","Ingredient_name": "(-)-(3S)-1,2,3,4-tetrahydro-\u03b2-carboline-3-carboxylic acid","Alias": "NA","Ingredient_formula": "C12H12N2O2","Ingredient_Smile": "C1C(NCC2=C1C3=CC=CC=C3N2)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40774","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6-(2-methoxy-z-vinyl)-7-methyl-pyranocoumarin
{"Ingredient_id": "HBIN012011","Ingredient_name": "6-(2-methoxy-z-vinyl)-7-methyl-pyranocoumarin","Alias": "NA","Ingredient_formula": "C13H12O3","Ingredient_Smile": "CC1=C(C=C2C=CC(=O)OC2=C1)C=COC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14097","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}