Exact Mass: 278.1994176
Exact Mass Matches: 278.1994176
Found 500 metabolites which its exact mass value is equals to given mass value 278.1994176
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Lycocernuine
1-(4-Hydroxy-3-methoxyphenyl)-3-decanone
1-(4-Hydroxy-3-methoxyphenyl)-3-decanone is found in alcoholic beverages. 1-(4-Hydroxy-3-methoxyphenyl)-3-decanone is from grains of paradise (Amomum melegueta) and ginger (Zingiber officinale).Paradol is the active flavor constituent of the seeds of Guinea pepper (Aframomum melegueta). The seed is also known as Grains of paradise. Paradol has been found to have antioxidative and antitumor promoting effects. It is used in flavors as an essential oil to give spiciness. (Wikipedia [6]-Paradol is a member of phenols, a ketone and a monomethoxybenzene. Paradol is a natural product found in Aframomum angustifolium, Aframomum melegueta, and Zingiber officinale with data available. From grains of paradise (Amomum melegueta) and ginger (Zingiber officinale) Paradol is a pungent phenolic substance found in ginger and other Zingiberaceae plants. Paradol is an effective inhibitor of tumor promotion in mouse skin carcinogenesis, binds to cyclooxygenase (COX)-2 active site. Paradol is a pungent phenolic substance found in ginger and other Zingiberaceae plants. Paradol is an effective inhibitor of tumor promotion in mouse skin carcinogenesis, binds to cyclooxygenase (COX)-2 active site.
Panaxytriol
Panaxytriol is found in tea. Panaxytriol is found in ginsen Found in ginseng
8-Acetoxy-4-acoren-3-one
8-Acetoxy-4-acoren-3-one is found in herbs and spices. 8-Acetoxy-4-acoren-3-one is a constituent of Acorus calamus (sweet flag)
Panaxacol
Panaxacol is found in tea. Panaxacol is present in ginseng. Present in ginseng. Panaxacol is found in tea.
Triprolidine
Triprolidine is only found in individuals that have used or taken this drug. It is the first generation histamine H1 antagonist used in allergic rhinitis; asthma; and urticaria. It is a component of cough and cold medicines. It may cause drowsiness. [PubChem]Triprolidine binds to the histamine H1 receptor. This blocks the action of endogenous histamine, which subsequently leads to temporary relief of the negative symptoms brought on by histamine. R - Respiratory system > R06 - Antihistamines for systemic use > R06A - Antihistamines for systemic use D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist D018926 - Anti-Allergic Agents
2-ethyl-1,5-dimethyl-3,3-diphenylpyrrolinium (EDDP)
2-ethyl-1,5-dimethyl-3,3-diphenylpyrrolinium (EDDP) is a metabolite of methadone. Methadone (also known as Symoron, Dolophine, Amidone, Methadose, Physeptone, Heptadon, Phy and many other names) is a synthetic opioid, used medically as an analgesic and a maintenance anti-addictive for use in patients with opioid dependency. It was developed in Germany in 1937. Although chemically unlike morphine or heroin, methadone acts on the same opioid receptors as these drugs, and thus has many of the same effects. (Wikipedia)
2-[1-(4-Methylphenyl)-3-(1-pyrrolidinyl)prop-1-enyl]pyridine
3-(3,5-Di-tert-butyl-4-hydroxyphenyl)propionic acid
D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D020011 - Protective Agents > D000975 - Antioxidants
Amydricaine
C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent
[1S-(1R*,2E,4R*,5R*,6E,10R*)]-3,7,11,11-Tetramethylbicyclo[8.1.0]undeca-2,6-diene-4,5-diol 5-acetate
[4aR-(4aalpha,5alpha,8abeta,9abeta)]-9a-Ethoxy-4a,5,6,7,8,8a,9,9a-octahydro-3,4a,5-trimethyl-naphtho[2,3-b]furan-2(4H)-one
4-epi-7alpha,15-dihydroxypodocarp-8(14)-en-13-one
[1S-(1R*,2E,4R*,5R*,6E,10R*)]-3,7,11,11-Tetramethylbicyclo[8.1.0]undeca-2,6-diene-4,5-diol 4-acetate
[S-[R*,S*-(E)]]-6-[6-(Acetyloxy)-1,5-dimethyl-4-hexenyl]-3-methyl-2-cyclohexen-1-one
3-[(Acetyloxy)methyl]-6-(1,5-dimethyl-4-hexenyl)-2-cyclohexen-1-one
Dimethocaine
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent
((1S*,2S*)-1-methoxy-5-(2-methoxyethyl)-2,4,6-trimethyl-2,3-dihydro-1H-inden-2-yl)methanol|applanatine A
(3Z,4R)-3-(dodec-11-en-1-ylidene)-4,5-dihydro-4-hydroxy-5-methylidenefuran-2(3H)-one|litsealiicolide B
(+)-oploxyne A|9,10-epoxyheptadeca-4,6-diyne-3,8-diol|oploxyne A
(1E,4R,4aR,5S,6R,8aR)-5,6-epoxy-4-isopropyl-6-methyl-3,4,4a,5,6,7,8,8a-octahydronaphthalene-1-methanol acetate
demethoxycarbonyl-3,14,15,16,17,18-hexahydrogambirtannine
1alpha-acetoxy-4alpha,14-epoxy-5,10-bis-epi-eudesma-11(13)-ene|Ac-(1alpha,4alpha,5beta,10alpha)-4,14-Epoxy-11-eudesmen-1-ol
1-Ac-(1alpha,5beta,10alpha)-4(15),11-Eudesmadiene-1,14-diol|1alpha-acetoxy-14-hydroxy-5,10-bis-epi-eudesma-4(15),11(13)-diene
1-Butanone, 1-[3,6-dimethyl-5-(1-hydroxy-3-methylbutyl)pyrazinyl]-3-methyl-
4beta-acetoxy-1alpha,2alpha-epoxy-bisabola-3(15),10-diene
2-Methylpropanoyl-3-Hydroxy-5,7-megastigmadien-9-one|Quiesone
1alpha-acetoxy-6beta,7alphaH-10alpha-methylisodauc-4-en-14-al
(2E,3R,4R,9E)-2-(dodeca-9,11-dienylidene)-3-hydroxy-4-methylbutanolide
7-Hydroxy-heptadeca-10t.16-dien-8-insaeure|7-Hydroxy-heptadecadien-(trans-10,16)-in-(8)-saeure|7-hydroxy-trans-10,16-heptadecadien-8-ynoic acid
15-hydroxyisocostic acid methyl ester 15-O-methyl ether
5-butyryl-dodecahydro-pyrido[2,1-f][1,6]naphthyridin-6-one|Haloxin
3-(1,3,5,7,9-Tetradecapentaenyloxy)-1,2-propanediol,
(3S,9S,10S)-heptadec-16-ene-4,6-diyne-3,9,10-triol|panaxjapyne C|panaxjapyne-C
(4R,5R,9R,10R,13R)-13-hydroxypodocarp-8(14)-en-19-oic acid
(2E)-3-formyl-5-(2,6,6-trimethylcyclohex-2-enyl)pent-2-enyl acetate
14-Ac-(1alpha,5beta,10alpha)-3,11-Eudesmadiene-1,14-diol|14-acetoxy-1alpha-hydroxy-5,10-bis-epi-eudesma-3,11(13)-diene
capsidiol 3-acetate
An acetate ester resulting from the formal condensation of the hydroxy group at position 3 of capsidiol with acetic acid. It is a phytoalexin produced by Nicotiana benthamiana against potato virus X.
14-Ac-(1alpha,5beta,10alpha)-4(15),11-Eudesmadiene-1,14-diol|14-acetoxy-1alpha-hydroxy-5,10-bis-epi-eudesma-4(15),11(13)-diene
acetic acid 1-methyl-3-(2,2,6-trimethyl-7-oxa-bicyclo[4.1.0]hept-1-yl)-1-vinyl-allyl ester
(5S)-3-(dodec-11-ynyl)-4-hydroxy-5-methylfuran-2(5H)-one|rotundifolide B
3-(3,5-Di-tert-butyl-4-hydroxyphenyl)propionic acid
D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D020011 - Protective Agents > D000975 - Antioxidants
C14-SAS (TENTATIVE)
TENTATIVELY IDENTIFIED SPECTRUM ONLY!!!!!!!!!; Extracted (without noise removal) from WIN_N: mz277_18_rt20_90_HCD60_C14-SAS; CONFIDENCE Tentative identification: best match only (Level 3)
NP1EC (TENTATIVE)
TENTATIVELY IDENTIFIED SPECTRUM ONLY!!!!!!!!!; Extracted (without noise removal) from ZUG_N: mz277_18_rt17_98_HCD60_NP1EC; CONFIDENCE Tentative identification: best match only (Level 3)
NPEC1
Literature spectrum; CONFIDENCE Tentative identification: isomers possible (Level 3); One of several possible homologues; Digitised from figure: approximate intensities
triprolidine
R - Respiratory system > R06 - Antihistamines for systemic use > R06A - Antihistamines for systemic use D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist D018926 - Anti-Allergic Agents
Poly(oxy-1,2-ethanediyl), .alpha.-2,4-bis(1,1-dimethylpropyl)phenyl-.omega.-hydroxy-
N-[[[(2-aminoethylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]ethane-1,2-diamine
C10H30N4OSi2 (278.19580499999995)
(S)-1N-BOC-2-(S-1-METHYLPROPYL)PIPERAZINE-HCl
C13H27ClN2O2 (278.17609519999996)
(S)-tert-Butyl 2-isobutylpiperazine-1-carboxylate hydrochloride
C13H27ClN2O2 (278.17609519999996)
1-(tetrahydro-2H-pyran-2-yl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
(R)-TERT-BUTYL 2-ISOBUTYLPIPERAZINE-1-CARBOXYLATE HYDROCHLORIDE
C13H27ClN2O2 (278.17609519999996)
1-(Tetrahydro-2H-pyran-2-yl)-1H-pyrazole-5-boronic acid pinacol ester
1-(Tetrahydro-2H-pyran-2-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
CIS-2-(2,6-DIMETHYLHEPTYL)-3-HYDROXY-3A,4,5,6,7,7A-HEXAHYDROINDEN-1-ONE
CIS-3-HYDROXY-2-NONYL-3A,4,5,6,7,7A-HEXAHYDROINDEN-1-ONE
(R)-tert-butyl 3-tert-butylpiperazine-1-carboxylate hydrochloride
C13H27ClN2O2 (278.17609519999996)
tert-butyl 3-tert-butylpiperazine-1-carboxylate hydrochloride
C13H27ClN2O2 (278.17609519999996)
(S)-4-N-BOC-2-ISOBUTYL-PIPERAZINE-HCl
C13H27ClN2O2 (278.17609519999996)
1-(Tetrahydro-2H-pyran-4-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
1-(3-(4-METHYLPIPERAZIN-1-YL)PROP-1-YNYL)CYCLOHEXYL ACETATE
(3AR,7AR)-OCTAHYDRO-2-[1-IMINO-2-(2-METHOXYPHENYL)ETHYL]-7,7-DIPHENYL-4H-ISOINDOL-4-ONE
1-(Tetrahydro-2H-pyran-2-yl)-1H-imidazole-5-boronic acid pinacol ester
2-(2-AMINO-6-(2-(DIPROPYLAMINO)ETHYL)PHENYL)ACETIC ACID
tert-butyl (2R)-2-butylpiperazine-1-carboxylate,hydrochloride
C13H27ClN2O2 (278.17609519999996)
(R)-4-N-BOC-2-ISOBUTYLPIPERAZINE-HCl
C13H27ClN2O2 (278.17609519999996)
tert-butyl (2S)-2-butylpiperazine-1-carboxylate,hydrochloride
C13H27ClN2O2 (278.17609519999996)
tert-butyl 3-(2-methylpropyl)piperazine-1-carboxylate,hydrochloride
C13H27ClN2O2 (278.17609519999996)
Diphemanil
A - Alimentary tract and metabolism > A03 - Drugs for functional gastrointestinal disorders > A03A - Drugs for functional gastrointestinal disorders > A03AB - Synthetic anticholinergics, quaternary ammonium compounds C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C29704 - Antimuscarinic Agent
Pyridine, 2-[1-(4-methylphenyl)-3-(1-pyrrolidinyl)-1-propenyl]-, (E)-
Paradol
Paradol is a pungent phenolic substance found in ginger and other Zingiberaceae plants. Paradol is an effective inhibitor of tumor promotion in mouse skin carcinogenesis, binds to cyclooxygenase (COX)-2 active site. Paradol is a pungent phenolic substance found in ginger and other Zingiberaceae plants. Paradol is an effective inhibitor of tumor promotion in mouse skin carcinogenesis, binds to cyclooxygenase (COX)-2 active site.
Fenozan
D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D020011 - Protective Agents > D000975 - Antioxidants
(3S,9R,10R)-Panaxytriol
A natural product found in Panax japonicus var. major.
11,13,15-Octadecatrienoic acid
Any octadecatrienoic acid with three fully-conjugated double bonds at positions 11, 13 and 15.
1,4-Benzenedipropanol, alpha,alpha,gamma,gamma,gamma,gamma-hexamethyl-
9,11,15-Octadecatrienoic acid
Any octadecatrienoic acid with three double bonds at positions 9, 11 and 15.
9,11,14-Octadecatrienoic acid
Any octadecatrienoic acid with three double bonds at positions 9, 11 and 14
6-(Diisopropylamino)-6-(thiophen-3-yl)hexanenitrile
(1S,12S,13R,14R,15E)-15-ethylidene-13-methyl-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene
(1R,2R,9S,10S)-7,15-Diazatetracyclo[7.7.1.02,7.010,15]heptadecane-6-carboxylic acid
(1R)-Decahydro-2beta,5,5,8abeta-tetramethyl-1beta-[(E)-3-oxo-1-butenyl]naphthalen-2alpha-ol
1-(2-(2-Methyl-5-pyridyl)ethyl)-2,3,5-trimethylindole
4-(Trimethylsilylmethyl)-3-cyclohexenyl 4-methyl-3-pentenyl ketone
C17H30OSi (278.20658099999997)
4-Isopropyl-7-(trimethylsilylmethyl)-3,4,4a,5,8,8a-hexahydro-1(2H)-naphthalenone
C17H30OSi (278.20658099999997)
4-Isopropyl-6-(trimethylsilylmethyl)-3,4,4a,5,8,8a-hexahydro-1(2H)-naphthalenone
C17H30OSi (278.20658099999997)
5-Isopropenyl-2-methyl-3-(1-trimethylsilylmethyl-2-propenyl)cyclohexan-1-one
C17H30OSi (278.20658099999997)
(8E,10E,12Z)-octadecatrienoic acid
A conjugated linolenic acid having three double bonds located at positions 8, 10 and 12 (the 8E,10E,12Z-geoisomer)
(E,E)-3,7,11-Trimethyl-2,6,10-dodecatrienyl propionate
(9Z)-octadec-9-en-12-ynoic acid
An octadecenynoic acid having a cis-double bond at C-9 and a triple bond at position 12.
(9Z,11E,15Z)-octadeca-9,11,15-trienoic acid
A 9,11,15-octadecatrienoic acid in which the configuration of the double bonds at positions 9 and 15 is Z, while that of the double bond at position 11 is E.
alpha-Linolenic acid
A linolenic acid with cis-double bonds at positions 9, 12 and 15. Shown to have an antithrombotic effect.
(5Z,9Z,12Z)-octadecatrienoic acid
An octadecatrienoic acid having three double bonds located at positions 5, 9 and 12 (the all-cis-isomer).
9,11,13-Octadecatrienoic acid
Any octadecatrienoic acid with three fully-conjugated double bonds at positions 9, 11 and 13.
(E,Z,E)-octadeca-9,11,13-trienoic acid
A 9,11,13-octadecatrienoic acid having its double bonds in trans, cis and trans configurations, respectively.
all-trans-octadeca-9,11,13-trienoic acid
The all-trans isomer of 9,11,13-octadecatrienoic acid.
(9Z,11E,13E)-octadeca-9,11,13-trienoic acid
A conjugated linolenic acid having three fully-conjugated double bonds at positions 9, 11 and 13, in cis, trans and trans configurations, respectively.
WE(18:3)
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(5e)-8-[(1r,5s)-5-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl]-6-methyloct-5-en-2-one
[1-methoxy-5-(2-methoxyethyl)-2,4,6-trimethyl-1,3-dihydroinden-2-yl]methanol
8-hydroxy-4,4a,6-trimethyl-3,4,7,8,9,10-hexahydro-2h-benzo[8]annulen-7-yl acetate
16-ethylidene-2-methylidene-4,14-diazatetracyclo[12.2.2.0³,¹¹.0⁵,¹⁰]octadeca-3(11),5,7,9-tetraene
13-hydroxy-6,10,14-trimethylpentadeca-5,9,14-trien-2-one
2-(2-hydroxy-4-methylphenyl)-6-methylheptan-4-yl acetate
3,4a,5-trimethyl-3ah,4h,5h,6h,7h,8h,8ah,9h,9ah-naphtho[2,3-b]furan-4-yl acetate
(1s)-1-[(1s,3ar,7s,7as)-7-isopropyl-4-methylidene-2-oxo-hexahydro-1h-inden-1-yl]ethyl acetate
2-[7-(hydroxymethyl)-6-pentyl-2,3-dihydro-1-benzofuran-2-yl]propan-2-ol
[(1s,2s,7s,8r,10r)-10-hydroxy-6,6-dimethyl-9-methylidenetricyclo[5.4.0.0²,⁸]undecan-2-yl]methyl acetate
(1s,2r,4r,7r,8ar)-4-hydroxy-1,8a-dimethyl-7-(prop-1-en-2-yl)-2,3,4,6,7,8-hexahydro-1h-naphthalen-2-yl acetate
(3e,4r,5r)-3-[(9e)-dodeca-9,11-dien-1-ylidene]-4-hydroxy-5-methyloxolan-2-one
14-hydroxy-11-methyl-2,17-diazatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadecan-3-one
8-[(2-oxopiperidin-1-yl)methyl]-octahydro-2h-quinoline-1-carbaldehyde
7-methyl-4-(prop-1-en-2-yl)-12-oxatricyclo[5.3.2.0¹,⁶]dodecan-10-yl acetate
4-[(1s,4ar,7s,8as)-7-hydroxy-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]butan-2-one
3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8,15-pentaene
(5e,10e,14r)-14-hydroxy-2,6,10-trimethylpentadeca-2,5,10-trien-4-one
(1s,2r,4s,6s,8s)-2-hydroxy-8,11,11-trimethyl-3-methylidenetricyclo[6.3.0.0²,⁶]undecan-4-yl acetate
(1r,5as,9as,9br)-1-ethoxy-6,6,9a-trimethyl-1h,5h,5ah,7h,8h,9h,9bh-naphtho[1,2-c]furan-3-one
(2s)-2-[(1r,8s,8as)-8,8a-dimethyl-2-oxo-1,3,4,6,7,8-hexahydronaphthalen-1-yl]propyl acetate
(2r)-2-[(1r,8s,8as)-8,8a-dimethyl-2-oxo-1,3,4,6,7,8-hexahydronaphthalen-1-yl]propyl acetate
6-formyl-4-isopropyl-1-methyl-3,4,4a,7,8,8a-hexahydro-2h-naphthalen-1-yl acetate
1-{1-methoxy-7,9b-dimethyl-3h,3ah,5ah,6h,7h,8h,9h,9ah-naphtho[1,2-c]furan-1-yl}ethanone
3-hydroxy-1,6-dimethyl-4-(propan-2-ylidene)-2,3,4a,7,8,8a-hexahydro-1h-naphthalen-2-yl acetate
(1s,2s,6s,7s,11s)-8-(hydroxymethyl)-1,2,6-trimethyltricyclo[5.3.1.0²,⁶]undec-8-en-11-yl acetate
(2e)-5-[(1r,4as,5s,8as)-5,8a-dimethyl-octahydro-1h-naphthalen-1-yl]-3-methylpent-2-enoic acid
(3z,4r)-3-(dodec-11-en-1-ylidene)-4-hydroxy-5-methylideneoxolan-2-one
1-[(1r,3ar,5as,7r,9ar,9bs)-1-methoxy-7,9b-dimethyl-3h,3ah,5ah,6h,7h,8h,9h,9ah-naphtho[1,2-c]furan-1-yl]ethanone
1-heptadecene-11,13-diyne-8,9,10-triol
{"Ingredient_id": "HBIN002571","Ingredient_name": "1-heptadecene-11,13-diyne-8,9,10-triol","Alias": "NA","Ingredient_formula": "C17H26O3","Ingredient_Smile": "CCCC#CC#CC(C(C(CCCCCC=C)O)O)O","Ingredient_weight": "278.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9201","PubChem_id": "10423696","DrugBank_id": "NA"}
1-hydroxy-2,6,10-farnesatrien-9-one
{"Ingredient_id": "HBIN002619","Ingredient_name": "1-hydroxy-2,6,10-farnesatrien-9-one","Alias": "NA","Ingredient_formula": "C17H26O3","Ingredient_Smile": "NA","Ingredient_weight": "278.39","OB_score": "NA","CAS_id": "75911-00-1","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9183","PubChem_id": "NA","DrugBank_id": "NA"}
2-acetoxyacorenone
{"Ingredient_id": "HBIN005111","Ingredient_name": "2-acetoxyacorenone","Alias": "NA","Ingredient_formula": "C17H26O3","Ingredient_Smile": "CC1CC(C(C12CC=C(C(=O)C2)C)C(C)C)OC(=O)C","Ingredient_weight": "278.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34411","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "10850234","DrugBank_id": "NA"}
9,12,15-Linolenic acid
{"Ingredient_id": "HBIN013978","Ingredient_name": "9,12,15-Linolenic acid","Alias": "NA","Ingredient_formula": "C18H30O2","Ingredient_Smile": "CCC=CCC=CCC=CCCCCCCCC(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40918","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}