Exact Mass: 202.0354
Exact Mass Matches: 202.0354
Found 500 metabolites which its exact mass value is equals to given mass value 202.0354,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Bergaptol
Bergaptol is a member of psoralens and a 5-hydroxyfurocoumarin. It is a conjugate acid of a bergaptol(1-). Bergaptol is a natural product found in Citrus canaliculata, Hansenia forbesii, and other organisms with data available. Bergaptol is a secondary metabolite of psoralen which has been hydroxylated by liver enzymes during phase I metabolism. Bergaptol is a biomarker for the consumption of citrus fruits. Present in various citrus subspecies Bergaptol is found in many foods, some of which are common hazelnut, hazelnut, alaska blueberry, and groundcherry. D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins Bergaptol is an inhibitor of debenzylation of the CYP3A4 enzyme with an IC50 of 24.92 uM. Recent studies have shown that it has anti-proliferative and anti-cancer properties. Bergaptol is an inhibitor of debenzylation of the CYP3A4 enzyme with an IC50 of 24.92 uM. Recent studies have shown that it has anti-proliferative and anti-cancer properties.
Xanthotoxol
Isolated from Aegle marmelos (bael fruit), Angelica archangelica (angelica) and the seeds of Pastinaca sativa (parsnip). Xanthotoxol is found in many foods, some of which are fats and oils, green vegetables, herbs and spices, and fig. Xanthotoxol is found in fats and oils. Xanthotoxol is isolated from Aegle marmelos (bael fruit), Angelica archangelica (angelica) and the seeds of Pastinaca sativa (parsnip Xanthotoxol is an 8-hydroxyfurocoumarin. Xanthotoxol is a natural product found in Citrus canaliculata, Prangos tschimganica, and other organisms with data available. D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins Xanthotoxol (8-Hydroxypsoralen) is a biologically active linear furocoumarin, shows strong pharmacological activities as anti-inflammatory, antioxidant, 5-HT antagonistic, and neuroprotective effects. Xanthotoxol (8-Hydroxypsoralen) It is a kind of fragrant bean substance, and it is a CYP450 inhibitor. Xanthotoxol has anti-inflammatory, anti-inflammatory, and 5-HT antagonistic and protective effects. Xanthotoxol inhibited CYP3A4 sum CYP1A2 IC50s separation 7.43 μM sum 27.82 μM. Xanthotoxol can pass through MAPK and NF-κB, inhibiting inflammation[1][2][3][4]. Xanthotoxol (8-Hydroxypsoralen) is a biologically active linear furocoumarin, shows strong pharmacological activities as anti-inflammatory, antioxidant, 5-HT antagonistic, and neuroprotective effects.
(2-Naphthalenyloxy)acetic acid
Plant growth regulator. (2-Naphthalenyloxy)acetic acid is used for control of preharvest fruit drop especially on grapes, pineapples, strawberries and tomatoe CONFIDENCE standard compound; EAWAG_UCHEM_ID 3716
4-Carboxy-2-hydroxy-cis,cis-muconate
Chlorphenesin
Chlorphenesin is only found in individuals that have used or taken this drug. It is a centrally acting muscle relaxant. Its mode of action is unknown. (From Martindale, The Extra Pharmacopoeia, 30th ed, p1203)The mechanism of action of chlorphenesin is not well defined, and its effects are measured mainly by subjective responses. It is known that chlorphenesin acts in the central nervous system (CNS) rather than directly on skeletal muscle. D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use D018373 - Peripheral Nervous System Agents > D009465 - Neuromuscular Agents C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent D002491 - Central Nervous System Agents
2-Oxo-4-hydroxy-4-carboxy-5-ureidoimidazoline
5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h-imidazole-5-carboxylate, also known as 2-oxo-4-hydroxy-4-carboxy-5-ureidoimidazoline, belongs to alpha amino acids and derivatives class of compounds. Those 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. 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h-imidazole-5-carboxylate is slightly soluble (in water) and a moderately acidic compound (based on its pKa). 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h-imidazole-5-carboxylate can be found in soy bean, which makes 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h-imidazole-5-carboxylate a potential biomarker for the consumption of this food product. 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h-imidazole-5-carboxylate exists in all living organisms, ranging from bacteria to humans. 2-Oxo-4-hydroxy-4-carboxy-5-ureidoimidazoline (CAS: 255828-59-2), also known as OHCU, 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. Outside of the human body, 2-oxo-4-hydroxy-4-carboxy-5-ureidoimidazoline has been detected, but not quantified, in soybeans. This could make 2-oxo-4-hydroxy-4-carboxy-5-ureidoimidazoline a potential biomarker for the consumption of these foods. 2-Oxo-4-hydroxy-4-carboxy-5-ureidoimidazoline is part of the purine metabolism pathway. It is a substrate for putative 2-oxo-4-hydroxy-4-carboxy-5-ureidoimidazoline decarboxylase.
1-(1-Naphthyl)-2-thiourea
D010575 - Pesticides > D012378 - Rodenticides D016573 - Agrochemicals
3-hydroxy-5-methyl-1-naphthoic acid
A member of the class of naphthoic acids that is 1-naphthoic acid substituted at positions 3 and 5 by hydroxy and methyl groups respectively.
2-hydroxy-5-methyl-1-naphthoic acid
A member of the class of naphthoic acids that is 1-naphthoic acid substituted at positions 2 and 5 by hydroxy and methyl groups respectively.
N(3)-fumaroyl-(S)-2,3-diaminopropanoic acid
An L-alanine derivative obtained by formal condensation of one of the carboxy groups of fumaric acid with the side-chain amino group of 3-amino-L-alanine.
1,4-Dioxo-1,4-dihydronaphthalene-2-carboxylic acid
Penmacric acid
Penmacric acid is a constituent of the seeds of the famine feed Pentaclethra macrophylla
5-Hydroxy-2,3-dimethyl-1,4-naphthoquinone
5-Hydroxy-2,3-dimethyl-1,4-naphthoquinone is found in nuts. 5-Hydroxy-2,3-dimethyl-1,4-naphthoquinone is a constituent of Juglans regia (walnut) and Juglans nigra (black walnut) Constituent of Juglans regia (walnut) and Juglans nigra (black walnut). 5-Hydroxy-2,3-dimethyl-1,4-naphthoquinone is found in nuts.
4-Chloro-3,5-dimethoxybenzyl alcohol
4-Chloro-3,5-dimethoxybenzyl alcohol is found in mushrooms. 4-Chloro-3,5-dimethoxybenzyl alcohol is isolated from the mycelium of Hericium erinaceum (lions mane). Isolated from the mycelium of Hericium erinaceum (lions mane). 4-Chloro-3,5-dimethoxybenzyl alcohol is found in mushrooms.
4-Ethylphenylsulfate
4-ethylphenylsulfate is also known as 4-Ethylphenylsulphuric acid. 4-ethylphenylsulfate is considered to be practically insoluble (in water) and acidic
3,4',5-Biphenyltriol
Constituent of Trifolium repens (white clover). 3,4,5-Biphenyltriol is found in tea, herbs and spices, and green vegetables. 3,4,5-Biphenyltriol is found in green vegetables. 3,4,5-Biphenyltriol is a constituent of Trifolium repens (white clover).
Ethyl aconitate
Ethyl aconitate is a flavouring ingredient. Prepd. as mixture of mono-, di- and triesters by acid-catalysed esterification of aconitic acid with EtOH or by heating
3-ethylphenyl Sulfate
3-ethylphenyl Sulfate is also known as 3-Ethylphenol sulfuric acid. 3-ethylphenyl Sulfate is considered to be practically insoluble (in water) and acidic
Succinylacetoacetate
Succinylacetoacetate is an intermediate that arises due to the incomplete breakdown of tyrosine (PMID: 7171740). It is produced as a result of defects in the enzyme called fumarylacetoacetase. Fumarylacetoacetase normally catalyzes the hydrolysis of 4-fumarylacetoacetate into fumarate and acetoacetate. If present in sufficiently high levels, succinylacetoacetate can act as an acidogen, an oncometabolite, and a metabotoxin. An acidogen is an acidic compound that induces acidosis, which has multiple adverse effects on many organ systems. An oncometabolite is an endogenous metabolite that causes cancer. A metabotoxin is an endogenously produced metabolite that causes adverse health effects at chronically high levels. Chronically high levels of succinylacetoacetate are associated with tyrosinemia type I. Type I tyrosinemia is an inherited metabolic disorder due to a shortage of the enzyme fumarylacetoacetate hydrolase that is needed to break down tyrosine. Patients usually develop features such as hepatic necrosis, renal tubular injury, and hypertrophic cardiomyopathy. Neurologic and dermatologic manifestations are also possible as well as hepatocellular carcinoma. The urine of tyrosinemia patients has an odour of cabbage or rancid butter. Succinylacetoacetate is an organic acid. Abnormally high levels of organic acids in the blood (organic acidemia), urine (organic aciduria), the brain, and other tissues lead to general metabolic acidosis. Acidosis typically occurs when arterial pH falls below 7.35. In infants with acidosis, the initial symptoms include poor feeding, vomiting, loss of appetite, weak muscle tone (hypotonia), and lack of energy (lethargy). These can progress to heart, liver, and kidney abnormalities, seizures, coma, and possibly death. These are also the characteristic symptoms of untreated tyrosinemia. Many affected children with organic acidemias experience intellectual disability or delayed development. Succinylacetoacetate appears to function as an oncometabolite (similar in function to succinate, another oncometabolite) as patients with high levels of this compound often develop hepatocellular carcinoma (PMID: 20003495).
2-Oxo-4-hydroxy-4-carboxy-5-ureidoimidazole
5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate, also known as 2-oxo-4-hydroxy-4-carboxy-5-ureidoimidazoline, 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. 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate is an extremely weak basic (essentially neutral) compound (based on its pKa). 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate exists in all living organisms, ranging from bacteria to humans. Outside of the human body, 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate has been detected, but not quantified in, soy beans. This could make 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate a potential biomarker for the consumption of these foods. 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h-imidazole-5-carboxylate is part of the Purine metabolism pathway. 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h-imidazole-5-carboxylate, also known as 2-oxo-4-hydroxy-4-carboxy-5-ureidoimidazoline, belongs to alpha amino acids and derivatives class of compounds. Those 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. 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h-imidazole-5-carboxylate is slightly soluble (in water) and a moderately acidic compound (based on its pKa). 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h-imidazole-5-carboxylate can be found in soy bean, which makes 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h-imidazole-5-carboxylate a potential biomarker for the consumption of this food product. 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h-imidazole-5-carboxylate exists in all living organisms, ranging from bacteria to humans.
Sodium cyclamate
Non-nutritive sweetener↵↵Cyclamate is an artificial sweetener that was discovered in 1937 at the University of Illinois by graduate student Michael Sveda. Non-nutritive sweetener
Magnesium lactate
Buffering agent; dough conditioner; dietary supplement. Magnesium lactate, the magnesium salt of lactic acid, is a mineral supplement. Buffering agent; dough conditioner; dietary supplement
1-(2,3-Dihydro-2-furyl)-4-(2-thienyl)-1t-buten-3-in|1-(2,3-Dihydro-2-furyl)-4-(thien-2-yl)but-1-en-3-yne
(4S,5R)-4-hydroxy-5-(octa-2,4,6-triyn-1-yl)dihydrofuran-2(3H)-one|4beta-hydroxy-3,4-dihydrovernoniyne
(5S)-5-(8-hydroxyocta-2,4,6-triyn-1-yl)dihydrofuran-2(3H)-one|8-hydroxy-3,4-dihydrovernoniyne
2,5-dihydroxy-3-methanesulfinylbenzyl alcohol
A benzyl alcohol with hydroxy substituents at positions 2 and 5 and a methanesulfinyl group at position 3. It is a fungal secondary metabolite from Ampelomyces sp. SC0307 and has antibacterial activity against Escherichia coli, Pseudomonas aeruginosa and Proteus vulgaris.
(E)-5-(Methylthio)-1-phenyl-4-penten-2-yn-1-one|trans-5-Methylthio-1-phenylpent-4-en-2-in-1-on
2-Phenyl-5,6-dihydro-4H-pyrrolo[3,4-d][1,3]thiazole
2-(2-CHLORO-6-FLUORO-PHENYL)-N-HYDROXY-ACETAMIDINE
1-(4-chlorophenyl)-3-[3-(4-chlorophenyl)-2-hydroxypropyl]sulfanylpropan-2-ol
4-HYDROXY-NAPHTHALENE-1-CARBOXYLIC ACID METHYL ESTER
Ethanone, 1-(3,4-dimethylphenyl)-2,2,2-trifluoro- (9CI)
TRIMETHYL(4-CHLORO-2-FLUOROPHENYL)SILANE 965-CHLORO-2-(TRIMETHYLSILYL)FLUOROBENZENE
Propanedinitrile,2-[1-(4-chlorophenyl)ethylidene]-
Urea, N-methoxy-N-methyl-N-(3-methyl-1,2,4-thiadiazol-5-yl)- (9CI)
4-CHLORO-1,3-DIMETHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID ETHYL ESTER
4-Methoxyphenyl mesylate, 4-[(Methylsulphonyl)oxy]anisole
3H-1,2,4-Triazino[5,6-b]indole-3-thione,2,4-dihydro-
4-CHLORO-2-(1,1-DIMETHYLETHYL)-5-HYDROXY-3(2H)-PYRIDAZINONE
6-Methyl-2-oxo-4-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile
2-amino-4,6-dimethyl-3-pyridinecarboxylic acid hydrochloride
SPIZOFURONE
C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent
ETHYL 4-HYDROXY-2-METHYLAMINOTHIAZOLE-5-CARBOXYLATE
4-Chloro-1-methyl-3-propyl-1H-pyrazole-5-carboxylic acid
4-CHLORO-1,3-DIETHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID
Magnesium lactate
A - Alimentary tract and metabolism > A12 - Mineral supplements > A12C - Other mineral supplements > A12CC - Magnesium
4-Methoxy-6-methyl-2-(methylsulfonyl)pyrimidine ,97
5,6,7,8-TETRAHYDROIMIDAZO[1,2-A]PYRIDINE-2-CARBOXYLIC ACID HYDROCHLORIDE
6-METHOXY-5-(TRIFLUOROMETHYL)-3-PYRIDINECARBONITRILE
Pyrrolo[2,1-b]thiazole-3-carboxylic acid, 6-aminohexahydro-5-oxo- (9CI)
2-(2-Chloro-4-fluoro-phenyl)-N-hydroxy-acetamidine
3-(TRIFLUOROMETHYL)[1,2,4]TRIAZOLO[4,3-A]PYRIDIN-8-AMINE
METHYL 5-(CHLOROCARBONYL)-1-METHYL-1H-PYRAZOLE-3-CARBOXYLATE
1-(PROP-2-YN-1-YL)-1H-PYRIDO[2,3-D][1,3]OXAZINE-2,4-DIONE
4-(Imidazo[1,2-a]pyrazin-2-yl)-1,2,5-oxadiazol-3-amine
(2,2-difluoro-2H-1,3-benzodioxol-5-yl)boronic acid
(FURAN-2-YLMETHANESULFINYL)-ACETIC ACID METHYL ESTER
5-METHYL-3-(TRIFLUOROMETHYL)-[1,2,4]TRIAZOLO[4,3-A]PYRAZINE
(R)-1-((5-amino-6-chloropyrimidin-4-yl)amino)propan-2-ol
2-[3-METHYL-2-(METHYLIMINO)-4-OXO-1,3-THIAZOLAN-5-YL]ACETIC ACID
3-Ethynyl-4-hydroxy-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
2-(2-formyl-1h-pyrrol-1-yl)thiophene-3-carbonitrile
Methyl amino(2-pyridinyl)acetate hydrochloride (1:1)
Ethanone, 1-(4-ethylphenyl)-2,2,2-trifluoro- (9CI)
Ethanone, 1-(2,4-dimethylphenyl)-2,2,2-trifluoro- (9CI)
6-Methoxy-2-naphthoic acid
6-Methoxy-2-naphthoic acid is an NMDA receptor modulator extracted from patent WO 2012019106 A2.
2-(5-Amino-1,2,4-thiadiazol-3-yl)-2-(methoxyimino)acetic acid
(2S,4R)-4-AMINOPYRROLIDINE-2-CARBOXYLIC ACID DIHYDROCHLORIDE
1,5-DIMETHYL-1H,5H-[1,2,4]TRIAZOLO[1,2-A][1,2,4]TRIAZOLE-3,7-DITHIOL
2-[[5-(TRIFLUOROMETHYL)-2-PYRIDYL]OXY]ACETONITRILE
4,5,6,7-Tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide hydrochloride
7-Hydroxy-2,3-dihydro-1H-cyclopenta[c]chromen-4-one
1-naphthoxyacetic acid
COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
3-Isocyanato-2-methyl-6-(trifluoromethyl)pyridine, TECH
1-METHYL-2,4-DIOXOHEXAHYDRO-5-PYRIMIDINECARBOXIMIDAMIDE
4(1H)-Pyrimidinone,6-(dimethoxymethyl)-2,3-dihydro-2-thioxo-
2-(2-METHYL-1H-IMIDAZOL-1-YL)-5-(TRIFLUOROMETHYL)ANILINE
5-(2-THIENYL)-7-(TRIFLUOROMETHYL)PYRAZOLO-[1,5-A]PYRIMIDINE-3-CARBOXYLIC ACID
4,5,6,7-TETRAHYDRO-1H-BENZO[D]IMIDAZOLE-5-CARBOXYLIC ACID HYDROCHLORIDE
6-FLUORO-3-METHYLBENZO[D]ISOXAZOL-5-AMINE HYDROCHLORIDE
2-PYRIDINECARBOXYLIC ACID, 4-AMINO-5-CHLORO-6-METHOXY-
Benzeneacetic acid,4-hydrazinyl-, hydrochloride (1:1)
Benzoic acid,4-hydrazinyl-, methyl ester, hydrochloride (1:1)
2-Naphthalenecarboxylic acid, 4-hydroxy-, Methyl ester
5-CHLOROMETHYL-FURAN-2-CARBOXYLIC ACID ISOPROPYL ESTER
1-Propene-1,2,3-tricarboxylic acid, 1-ethyl ester, (1Z)-
Methyl 4,4,4-trifluoro-3-hydroxy-3-methoxybutanoate
Xanthotoxol
D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins Xanthotoxol (8-Hydroxypsoralen) is a biologically active linear furocoumarin, shows strong pharmacological activities as anti-inflammatory, antioxidant, 5-HT antagonistic, and neuroprotective effects. Xanthotoxol (8-Hydroxypsoralen) It is a kind of fragrant bean substance, and it is a CYP450 inhibitor. Xanthotoxol has anti-inflammatory, anti-inflammatory, and 5-HT antagonistic and protective effects. Xanthotoxol inhibited CYP3A4 sum CYP1A2 IC50s separation 7.43 μM sum 27.82 μM. Xanthotoxol can pass through MAPK and NF-κB, inhibiting inflammation[1][2][3][4]. Xanthotoxol (8-Hydroxypsoralen) is a biologically active linear furocoumarin, shows strong pharmacological activities as anti-inflammatory, antioxidant, 5-HT antagonistic, and neuroprotective effects.
Bergaptol
D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins Bergaptol is an inhibitor of debenzylation of the CYP3A4 enzyme with an IC50 of 24.92 uM. Recent studies have shown that it has anti-proliferative and anti-cancer properties. Bergaptol is an inhibitor of debenzylation of the CYP3A4 enzyme with an IC50 of 24.92 uM. Recent studies have shown that it has anti-proliferative and anti-cancer properties.
Sodium cyclamate
Non-nutritive sweetener↵↵Cyclamate is an artificial sweetener that was discovered in 1937 at the University of Illinois by graduate student Michael Sveda. D000074385 - Food Ingredients > D005503 - Food Additives D010592 - Pharmaceutic Aids > D005421 - Flavoring Agents Non-nutritive sweetener
3-(indol-3-yl)Pyruvate
A indol-3-yl carboxylic acid anion that is the conjugate base of 3-(indol-3-yl)pyruvic acid
(2E)-3-(3,4-dioxocyclohexa-1,5-dien-1-yl)-2-isocyanoprop-2-enoate
Tyrphostin A25
D000970 - Antineoplastic Agents > D020032 - Tyrphostins D004791 - Enzyme Inhibitors
(1E,3Z)-4-hydroxybuta-1,3-diene-1,2,4-tricarboxylic acid
chlorphenesin
D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use D018373 - Peripheral Nervous System Agents > D009465 - Neuromuscular Agents C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent D002491 - Central Nervous System Agents
3,5-Dioxooctanedioic acid
An alpha,omega-dicarboxylic acid that is suberic acid which oxo groups replace the hydrogens at positions 3 and 5. It is an abnormal metabolite of the tyrosine metabolic pathway and a marker for type 1 tyrosinaemia.
2-Oxo-4-hydroxy-4-carboxy-5-ureidoimidazoline
3-ethylphenyl Sulfate
An aryl sulfate that is ethylbenzene substituted by a sulfooxy group at position 3.
4-ethylphenyl sulfate
An aryl sulfate that is 4-ethylphenol in which the hydroxy group has been replaced by a sulfooxy group.
(10s)-10-ethyl-3,11-dioxatricyclo[7.3.0.0²,⁶]dodeca-1,4,6,8-tetraen-12-one
1-(2,3-dihydro-2-furyl)-4-(thien-2-yl)but-1-en-3-yne
{"Ingredient_id": "HBIN000614","Ingredient_name": "1-(2,3-dihydro-2-furyl)-4-(thien-2-yl)but-1-en-3-yne","Alias": "NA","Ingredient_formula": "C12H10OS","Ingredient_Smile": "NA","Ingredient_weight": "202.276","OB_score": "NA","CAS_id": "55309-65-4","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9712","PubChem_id": "NA","DrugBank_id": "NA"}
5-(methylthio)-1-phenyl-4-penten-2-yn-1-one
{"Ingredient_id": "HBIN011822","Ingredient_name": "5-(methylthio)-1-phenyl-4-penten-2-yn-1-one","Alias": "NA","Ingredient_formula": "C12H10OS","Ingredient_Smile": "NA","Ingredient_weight": "202.27","OB_score": "NA","CAS_id": "54668-03-0","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7732","PubChem_id": "NA","DrugBank_id": "NA"}
