Exact Mass: 202.0357

Exact Mass Matches: 202.0357

Found 166 metabolites which its exact mass value is equals to given mass value 202.0357, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Bergaptol

7H-Furo(3,2-g)(1)benzopyran-7-one, 4-hydroxy- (8CI)(9CI)

C11H6O4 (202.0266)


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

9-hydroxy-7H-furo[3,2-g]chromen-7-one

C11H6O4 (202.0266)


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.

   

Chlorphenesin

3-(4-Chlorophenoxy)-1,2-propanediol

C9H11ClO3 (202.0397)


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

(5S)-2,5-Dihydroxy-4-[(C-hydroxycarbonimidoyl)imino]-4,5-dihydro-1H-imidazole-5-carboxylate

C5H6N4O5 (202.0338)


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.

   

Isobergaptol

Isobergaptol

C11H6O4 (202.0266)


   

Heratomol

6-Hydroxyangelicin

C11H6O4 (202.0266)


   

1,4-Dioxo-1,4-dihydronaphthalene-2-carboxylic acid

1,4-Dioxo-1,4-dihydronaphthalene-2-carboxylic acid

C11H6O4 (202.0266)


   

4-Chloro-3,5-dimethoxybenzyl alcohol

(4-chloro-3,5-dimethoxyphenyl)methanol

C9H11ClO3 (202.0397)


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-ethylphenyl)oxidanesulfonic acid

C8H10O4S (202.03)


4-ethylphenylsulfate is also known as 4-Ethylphenylsulphuric acid. 4-ethylphenylsulfate is considered to be practically insoluble (in water) and acidic

   

3-ethylphenyl Sulfate

(3-ethylphenyl)oxidanesulfonic acid

C8H10O4S (202.03)


3-ethylphenyl Sulfate is also known as 3-Ethylphenol sulfuric acid. 3-ethylphenyl Sulfate is considered to be practically insoluble (in water) and acidic

   

Tyrphostin A25

2-[(3,4,5-trihydroxyphenyl)methylidene]propanedinitrile

C10H6N2O3 (202.0378)


   

2-Oxo-4-hydroxy-4-carboxy-5-ureidoimidazole

4-(carbamoylamino)-5-hydroxy-2-oxo-2,5-dihydro-1H-imidazole-5-carboxylic acid

C5H6N4O5 (202.0338)


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.

   

Magnesium lactate

magnesium(2+) ion bis(2-hydroxypropanoate)

C6H10MgO6 (202.0328)


Buffering agent; dough conditioner; dietary supplement. Magnesium lactate, the magnesium salt of lactic acid, is a mineral supplement. Buffering agent; dough conditioner; dietary supplement

   

Sulfinyldibenzene

Diphenyl sulfoxide

C12H10OS (202.0452)


   

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

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

C12H10OS (202.0452)


   

S-(2-pyrrolyl)cysteine S-oxide

S-(2-pyrrolyl)cysteine S-oxide

C7H10N2O3S (202.0412)


   
   

2,5-dihydroxy-3-methanesulfinylbenzyl alcohol

2,5-dihydroxy-3-methanesulfinylbenzyl alcohol

C8H10O4S (202.03)


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

(E)-5-(Methylthio)-1-phenyl-4-penten-2-yn-1-one|trans-5-Methylthio-1-phenylpent-4-en-2-in-1-on

C12H10OS (202.0452)


   

AG-82

2-[(3,4,5-trihydroxyphenyl)methylene]-propanedinitrile

C10H6N2O3 (202.0378)


   

1,4-naphthoquinone-2-carboxylic acid

1,4-naphthoquinone-2-carboxylic acid

C11H6O4 (202.0266)


   

Diphenylsulfoxide

Diphenyl sulfoxide

C12H10OS (202.0452)


CONFIDENCE standard compound; INTERNAL_ID 8088

   

4-Chloro-3,5-dimethoxybenzyl alcohol

(4-chloro-3,5-dimethoxyphenyl)methanol

C9H11ClO3 (202.0397)


   

Sulfamic acid, (6-ethyl-2-pyridinyl)- (9CI)

Sulfamic acid, (6-ethyl-2-pyridinyl)- (9CI)

C7H10N2O3S (202.0412)


   

3-Cyclohexyl-2-bromopropene

3-Cyclohexyl-2-bromopropene

C9H15Br (202.0357)


   

Benzofuro[3,2-d]pyrimidine-2,4(1H,3H)-dione

Benzofuro[3,2-d]pyrimidine-2,4(1H,3H)-dione

C10H6N2O3 (202.0378)


   

2-(2-CHLORO-6-FLUORO-PHENYL)-N-HYDROXY-ACETAMIDINE

2-(2-CHLORO-6-FLUORO-PHENYL)-N-HYDROXY-ACETAMIDINE

C8H8ClFN2O (202.0309)


   

2-(2,2,2-trifluoroethoxy)pyridine-3-carbonitrile

2-(2,2,2-trifluoroethoxy)pyridine-3-carbonitrile

C8H5F3N2O (202.0354)


   

2-Chloro-3,4-Dimethoxybenzyl Alcohol

(2-Chloro-3,4-dimethoxyphenyl)methanol

C9H11ClO3 (202.0397)


   

4,6-dimethoxy-2-methylsulfinylpyrimidine

4,6-dimethoxy-2-methylsulfinylpyrimidine

C7H10N2O3S (202.0412)


   

2-AMINO-5-(TRIFLUOROMETHYL)BENZONITRILE

2-AMINO-5-(TRIFLUOROMETHYL)BENZONITRILE

C8H5F3N2O (202.0354)


   

1,2-bis(chloromethyl)-4,5-dimethylbenzene

1,2-bis(chloromethyl)-4,5-dimethylbenzene

C10H12Cl2 (202.0316)


   

4-Methoxybenzenesulfonohydrazide

4-Methoxybenzenesulfonohydrazide

C7H10N2O3S (202.0412)


   

1,4-BIS(2-CHLOROETHYL)BENZENE

1,4-BIS(2-CHLOROETHYL)BENZENE

C10H12Cl2 (202.0316)


   

2-Piperazinecarboxylic acid dihydrochloride

2-Piperazinecarboxylic acid dihydrochloride

C5H12Cl2N2O2 (202.0276)


   

4-nitropyridine-2-carboximidamide,hydrochloride

4-nitropyridine-2-carboximidamide,hydrochloride

C6H7ClN4O2 (202.0258)


   

5-nitropyridine-2-carboximidamide,hydrochloride

5-nitropyridine-2-carboximidamide,hydrochloride

C6H7ClN4O2 (202.0258)


   

6-nitropyridine-2-carboximidamide,hydrochloride

6-nitropyridine-2-carboximidamide,hydrochloride

C6H7ClN4O2 (202.0258)


   

3-nitropyridine-2-carboximidamide,hydrochloride

3-nitropyridine-2-carboximidamide,hydrochloride

C6H7ClN4O2 (202.0258)


   

4-(Difluoromethoxy)-3-methoxybenzaldehyde

4-(Difluoromethoxy)-3-methoxybenzaldehyde

C9H8F2O3 (202.0441)


   

4-CHLORO-5-ISOPROPYL-6-(METHYLTHIO)PYRIMIDINE

4-CHLORO-5-ISOPROPYL-6-(METHYLTHIO)PYRIMIDINE

C8H11ClN2S (202.0331)


   

2-(4-Chlorophenyl)-1H-pyrrole-3-carbonitrile

2-(4-Chlorophenyl)-1H-pyrrole-3-carbonitrile

C11H7ClN2 (202.0298)


   

AKOS B016267

AKOS B016267

C12H10OS (202.0452)


   

2,3-difluoro-4-ethoxybenzoic acid

2,3-difluoro-4-ethoxybenzoic acid

C9H8F2O3 (202.0441)


   

4-PHENOXYTHIOPHENOL

4-PHENOXYTHIOPHENOL

C12H10OS (202.0452)


   

TRIMETHYL(4-CHLORO-2-FLUOROPHENYL)SILANE 965-CHLORO-2-(TRIMETHYLSILYL)FLUOROBENZENE

TRIMETHYL(4-CHLORO-2-FLUOROPHENYL)SILANE 965-CHLORO-2-(TRIMETHYLSILYL)FLUOROBENZENE

C9H12ClFSi (202.0381)


   

Propanedinitrile,2-[1-(4-chlorophenyl)ethylidene]-

Propanedinitrile,2-[1-(4-chlorophenyl)ethylidene]-

C11H7ClN2 (202.0298)


   

1-Bromo-4-propylcyclohex-1-ene

1-Bromo-4-propylcyclohex-1-ene

C9H15Br (202.0357)


   
   

4-Methoxyphenyl mesylate, 4-[(Methylsulphonyl)oxy]anisole

4-Methoxyphenyl mesylate, 4-[(Methylsulphonyl)oxy]anisole

C8H10O4S (202.03)


   

3H-1,2,4-Triazino[5,6-b]indole-3-thione,2,4-dihydro-

3H-1,2,4-Triazino[5,6-b]indole-3-thione,2,4-dihydro-

C9H6N4S (202.0313)


   

8-Nitro-7-quinolinecarbaldehyde

8-Nitro-7-quinolinecarbaldehyde

C10H6N2O3 (202.0378)


   

4-phenylsulfanylphenol

4-phenylsulfanylphenol

C12H10OS (202.0452)


   

5-nitroquinoline-6-carbaldehyde

5-nitroquinoline-6-carbaldehyde

C10H6N2O3 (202.0378)


   

1,2-Dichloro(1,1-dimethylethyl)benzene

1,2-Dichloro(1,1-dimethylethyl)benzene

C10H12Cl2 (202.0316)


   

7-TRIFLUOROMETHYL-BENZO[D]ISOXAZOL-3-YLAMINE

7-TRIFLUOROMETHYL-BENZO[D]ISOXAZOL-3-YLAMINE

C8H5F3N2O (202.0354)


   

Benzene,1,5-bis(chloromethyl)-2,4-dimethyl-

Benzene,1,5-bis(chloromethyl)-2,4-dimethyl-

C10H12Cl2 (202.0316)


   

2-(PENTAFLUORO-1-PROPENYL)TETRAHYDROFURAN

2-(PENTAFLUORO-1-PROPENYL)TETRAHYDROFURAN

C7H7F5O (202.0417)


   

6-Methyl-2-oxo-4-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile

3-Pyridinecarbonitrile,1,2-dihydro-6-methyl-2-oxo-4-(trifluoromethyl)-

C8H5F3N2O (202.0354)


   

2-Chloro-4-methyl quinoline-3-carbonitrile

2-Chloro-4-methyl quinoline-3-carbonitrile

C11H7ClN2 (202.0298)


   

2-(2-chloro-4-fluorophenyl)acetohydrazide

2-(2-chloro-4-fluorophenyl)acetohydrazide

C8H8ClFN2O (202.0309)


   

ETHYL 4-HYDROXY-2-METHYLAMINOTHIAZOLE-5-CARBOXYLATE

ETHYL 4-HYDROXY-2-METHYLAMINOTHIAZOLE-5-CARBOXYLATE

C7H10N2O3S (202.0412)


   

5-M-TOLYL-THIOPHENE-2-CARBALDEHYDE

5-M-TOLYL-THIOPHENE-2-CARBALDEHYDE

C12H10OS (202.0452)


   

6-Nitro-2-quinolinecarbaldehyde

6-Nitro-2-quinolinecarbaldehyde

C10H6N2O3 (202.0378)


   

4-(ACETYLTHIO)-1,2-DIFORMYLPYRAZOLIDINE

4-(ACETYLTHIO)-1,2-DIFORMYLPYRAZOLIDINE

C7H10N2O3S (202.0412)


   

5-(trifluoromethoxy)-1H-indazole

5-(trifluoromethoxy)-1H-indazole

C8H5F3N2O (202.0354)


   

2-chloro-7-methylquinoline-3-carbonitrile

2-chloro-7-methylquinoline-3-carbonitrile

C11H7ClN2 (202.0298)


   

(3-(TRIFLUOROMETHOXY)PHENYL)ACETONE

(3-(TRIFLUOROMETHOXY)PHENYL)ACETONE

C10H6F4 (202.0406)


   

Magnesium lactate

Magnesium lactate

C6H10MgO6 (202.0328)


A - Alimentary tract and metabolism > A12 - Mineral supplements > A12C - Other mineral supplements > A12CC - Magnesium

   

Propanoic acid,3-(2,4-difluorophenoxy)-

Propanoic acid,3-(2,4-difluorophenoxy)-

C9H8F2O3 (202.0441)


   

5-O-TOLYL-THIOPHENE-2-CARBALDEHYDE

5-O-TOLYL-THIOPHENE-2-CARBALDEHYDE

C12H10OS (202.0452)


   

4-Methoxy-6-methyl-2-(methylsulfonyl)pyrimidine ,97

4-Methoxy-6-methyl-2-(methylsulfonyl)pyrimidine ,97

C7H10N2O3S (202.0412)


   

6-(Trifluoromethyl)-1,2-dihydro-3H-indazol-3-one

6-(Trifluoromethyl)-1,2-dihydro-3H-indazol-3-one

C8H5F3N2O (202.0354)


   

o-(Phenylthio)phenol

o-(Phenylthio)phenol

C12H10OS (202.0452)


   

6-METHOXY-5-(TRIFLUOROMETHYL)-3-PYRIDINECARBONITRILE

6-METHOXY-5-(TRIFLUOROMETHYL)-3-PYRIDINECARBONITRILE

C8H5F3N2O (202.0354)


   

2-(3,5-difluoro-4-methoxyphenyl)acetic acid

2-(3,5-difluoro-4-methoxyphenyl)acetic acid

C9H8F2O3 (202.0441)


   

2-Amino-5-methoxy-benzene sulphonamide

2-Amino-5-methoxy-benzene sulphonamide

C7H10N2O3S (202.0412)


   

2-(2,2,2-trifluoroethoxy)pyridine-5-carbonitrile

2-(2,2,2-trifluoroethoxy)pyridine-5-carbonitrile

C8H5F3N2O (202.0354)


   

Pyrrolo[2,1-b]thiazole-3-carboxylic acid, 6-aminohexahydro-5-oxo- (9CI)

Pyrrolo[2,1-b]thiazole-3-carboxylic acid, 6-aminohexahydro-5-oxo- (9CI)

C7H10N2O3S (202.0412)


   

2-(2-Chloro-4-fluoro-phenyl)-N-hydroxy-acetamidine

2-(2-Chloro-4-fluoro-phenyl)-N-hydroxy-acetamidine

C8H8ClFN2O (202.0309)


   

2,6-DIFLUORO-3-METHOXYPHENYLACETIC ACID

2,6-DIFLUORO-3-METHOXYPHENYLACETIC ACID

C9H8F2O3 (202.0441)


   

2-AMINO-4-METHYLAMINOBENZENE SULFONIC ACID

2-AMINO-4-METHYLAMINOBENZENE SULFONIC ACID

C7H10N2O3S (202.0412)


   

1-(PROP-2-YN-1-YL)-1H-PYRIDO[2,3-D][1,3]OXAZINE-2,4-DIONE

1-(PROP-2-YN-1-YL)-1H-PYRIDO[2,3-D][1,3]OXAZINE-2,4-DIONE

C10H6N2O3 (202.0378)


   

1-(5-Phenylthiophen-2-yl)ethanone

1-(5-Phenylthiophen-2-yl)ethanone

C12H10OS (202.0452)


   

Vanadium(V) oxytriethoxide

Vanadium(V) oxytriethoxide

C6H15O4V (202.041)


   

bis(2-hydroxyethyl)ammonium hydrogen sulphate

bis(2-hydroxyethyl)ammonium hydrogen sulphate

C4H12NO6S (202.0385)


   

(FURAN-2-YLMETHANESULFINYL)-ACETIC ACID METHYL ESTER

(FURAN-2-YLMETHANESULFINYL)-ACETIC ACID METHYL ESTER

C8H10O4S (202.03)


   

Benzene,1,4-bis(chloromethyl)-2,5-dimethyl-

Benzene,1,4-bis(chloromethyl)-2,5-dimethyl-

C10H12Cl2 (202.0316)


   

IFLAB-BB F2124-0138

IFLAB-BB F2124-0138

C6H7ClN4O2 (202.0258)


   

(4-METHOXY-2-NITROPHENYL)ACETONITRILE

(4-METHOXY-2-NITROPHENYL)ACETONITRILE

C8H11O4P (202.0395)


   

N-methylbenzenecarbothiohydrazide,hydrochloride

N-methylbenzenecarbothiohydrazide,hydrochloride

C8H11ClN2S (202.0331)


   

2-(3,4-difluoro-5-methoxyphenyl)acetic acid

2-(3,4-difluoro-5-methoxyphenyl)acetic acid

C9H8F2O3 (202.0441)


   

2-(2-Chloro-6-fluorophenyl)acetohydrazide

2-(2-Chloro-6-fluorophenyl)acetohydrazide

C8H8ClFN2O (202.0309)


   

2-(PHENYLTHIO)ACETAMIDINE HYDROCHLORIDE

2-(PHENYLTHIO)ACETAMIDINE HYDROCHLORIDE

C8H11ClN2S (202.0331)


   

3-Amino-4-hydroxy-N-methylbenzenesulfonamide

3-Amino-4-hydroxy-N-methylbenzenesulfonamide

C7H10N2O3S (202.0412)


   

2-chloro-N,N-dimethyl-5-nitropyrimidin-4-amine

2-chloro-N,N-dimethyl-5-nitropyrimidin-4-amine

C6H7ClN4O2 (202.0258)


   

4-Ethoxy-2,3-difluorobenzoic acid

4-Ethoxy-2,3-difluorobenzoic acid

C9H8F2O3 (202.0441)


   

2-[3-METHYL-2-(METHYLIMINO)-4-OXO-1,3-THIAZOLAN-5-YL]ACETIC ACID

2-[3-METHYL-2-(METHYLIMINO)-4-OXO-1,3-THIAZOLAN-5-YL]ACETIC ACID

C7H10N2O3S (202.0412)


   

2-(2,4-difluorophenoxy)propanoic acid

2-(2,4-difluorophenoxy)propanoic acid

C9H8F2O3 (202.0441)


   

Methyl 3,5-diamino-6-chloropyrazine-2-carboxylate

Methyl 3,5-diamino-6-chloropyrazine-2-carboxylate

C6H7ClN4O2 (202.0258)


   

2-amino-1-phenol 4-methylsulfonamide

2-amino-1-phenol 4-methylsulfonamide

C7H10N2O3S (202.0412)


   

3-Ethynyl-4-hydroxy-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid

3-Ethynyl-4-hydroxy-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid

C10H6N2O3 (202.0378)


   

3-(difluoromethoxy)-4-methoxybenzaldehyde

3-(difluoromethoxy)-4-methoxybenzaldehyde

C9H8F2O3 (202.0441)


   

2,6-Diaminotoluene-4-sulfonic acid

2,6-Diaminotoluene-4-sulfonic acid

C7H10N2O3S (202.0412)


   

2-chloro-6-methylquinoline-3-carbonitrile

2-chloro-6-methylquinoline-3-carbonitrile

C11H7ClN2 (202.0298)


   

s-benzylisothiourea hydrochloride

s-benzylisothiourea hydrochloride

C8H11ClN2S (202.0331)


   

5-(2-aminopyrimidin-4-yl)thiophene-2-carbonitrile

5-(2-aminopyrimidin-4-yl)thiophene-2-carbonitrile

C9H6N4S (202.0313)


   

4-Amino-3-trifluoromethoxybenzonitrile

4-Amino-3-(trifluoromethoxy)benzonitrile

C8H5F3N2O (202.0354)


   

2,6-Difluoro-4-ethoxybenzoic acid

2,6-Difluoro-4-ethoxybenzoic acid

C9H8F2O3 (202.0441)


   

4-chloro-6-methylquinoline-3-carbonitrile

4-chloro-6-methylquinoline-3-carbonitrile

C11H7ClN2 (202.0298)


   

2-amino-6-methoxybenzenesulfonamide

2-amino-6-methoxybenzenesulfonamide

C7H10N2O3S (202.0412)


   

2-chloro-8-methylquinoline-3-carbonitrile

2-chloro-8-methylquinoline-3-carbonitrile

C11H7ClN2 (202.0298)


   

(2S,4R)-4-AMINOPYRROLIDINE-2-CARBOXYLIC ACID DIHYDROCHLORIDE

(2S,4R)-4-AMINOPYRROLIDINE-2-CARBOXYLIC ACID DIHYDROCHLORIDE

C5H12Cl2N2O2 (202.0276)


   

1,5-DIMETHYL-1H,5H-[1,2,4]TRIAZOLO[1,2-A][1,2,4]TRIAZOLE-3,7-DITHIOL

1,5-DIMETHYL-1H,5H-[1,2,4]TRIAZOLO[1,2-A][1,2,4]TRIAZOLE-3,7-DITHIOL

C6H10N4S2 (202.0347)


   

2-[[5-(TRIFLUOROMETHYL)-2-PYRIDYL]OXY]ACETONITRILE

2-[[5-(TRIFLUOROMETHYL)-2-PYRIDYL]OXY]ACETONITRILE

C8H5F3N2O (202.0354)


   

5-(2-FURYL)-3-(TRIFLUOROMETHYL)PYRAZOLE

5-(2-FURYL)-3-(TRIFLUOROMETHYL)PYRAZOLE

C8H5F3N2O (202.0354)


   

4-amino-2-(trifluoromethoxy)benzonitrile

4-amino-2-(trifluoromethoxy)benzonitrile

C8H5F3N2O (202.0354)


   

Bis(dimethylamino)phosphorylchloride,93+

Bis(dimethylamino)phosphorylchloride,93+

C4H12ClN2O3P (202.0274)


   

1-(4-thiophen-2-ylphenyl)ethanone

1-(4-thiophen-2-ylphenyl)ethanone

C12H10OS (202.0452)


   

(2,5-DIFLUORO-1,4-PHENYLENE)DIBORONIC ACID

(2,5-DIFLUORO-1,4-PHENYLENE)DIBORONIC ACID

C6H6B2F2O4 (202.042)


   

3-(3,4-difluorophenoxy)propanoic acid

3-(3,4-difluorophenoxy)propanoic acid

C9H8F2O3 (202.0441)


   

6-TRIFLUOROMETHYL-BENZO[D]ISOXAZOL-3-YLAMINE

6-TRIFLUOROMETHYL-BENZO[D]ISOXAZOL-3-YLAMINE

C8H5F3N2O (202.0354)


   

3-Isocyanato-2-methyl-6-(trifluoromethyl)pyridine, TECH

3-Isocyanato-2-methyl-6-(trifluoromethyl)pyridine, TECH

C8H5F3N2O (202.0354)


   

4(1H)-Pyrimidinone,6-(dimethoxymethyl)-2,3-dihydro-2-thioxo-

4(1H)-Pyrimidinone,6-(dimethoxymethyl)-2,3-dihydro-2-thioxo-

C7H10N2O3S (202.0412)


   

1-(4-thiophen-3-ylphenyl)ethanone

1-(4-thiophen-3-ylphenyl)ethanone

C12H10OS (202.0452)


   

2,6-Difluoro-4-methoxyphenylacetic acid

2,6-Difluoro-4-methoxyphenylacetic acid

C9H8F2O3 (202.0441)


   

6-FLUORO-3-METHYLBENZO[D]ISOXAZOL-5-AMINE HYDROCHLORIDE

6-FLUORO-3-METHYLBENZO[D]ISOXAZOL-5-AMINE HYDROCHLORIDE

C8H8ClFN2O (202.0309)


   

5-AMINO-2-METHOXY-BENZENESULFONAMIDE

5-AMINO-2-METHOXY-BENZENESULFONAMIDE

C7H10N2O3S (202.0412)


   

1-(2-HYDROXY-4-METHOXYPHENYL)-2-PHENYLETHANONE

1-(2-HYDROXY-4-METHOXYPHENYL)-2-PHENYLETHANONE

C7H10N2O3S (202.0412)


   

5-(TRIFLUOROMETHYL)-1H-BENZO[D]IMIDAZOL-2(3H)-ONE

5-(TRIFLUOROMETHYL)-1H-BENZO[D]IMIDAZOL-2(3H)-ONE

C8H5F3N2O (202.0354)


   

2-CHLORO-1H-NAPHTHO[2,3-D]IMIDAZOLE

2-CHLORO-1H-NAPHTHO[2,3-D]IMIDAZOLE

C11H7ClN2 (202.0298)


   

IFLAB-BB F2124-0124

IFLAB-BB F2124-0124

C6H7ClN4O2 (202.0258)


   

4-(Thien-2-ylmethyl)benzaldehyde

4-(Thien-2-ylmethyl)benzaldehyde

C12H10OS (202.0452)


   

2-(Difluoromethoxy)phenylacetic acid

2-(Difluoromethoxy)phenylacetic acid

C9H8F2O3 (202.0441)


   

5-CHLOROMETHYL-FURAN-2-CARBOXYLIC ACID ISOPROPYL ESTER

5-CHLOROMETHYL-FURAN-2-CARBOXYLIC ACID ISOPROPYL ESTER

C9H11ClO3 (202.0397)


   

(4R)-4-Amino-D-proline dihydrochloride

(4R)-4-Amino-D-proline dihydrochloride

C5H12Cl2N2O2 (202.0276)


   

4-Ethylphenyl hydrogen sulfate

4-Ethylphenyl hydrogen sulfate

C8H10O4S (202.03)


   

5-(Trifluoromethyl)-1,2-Benzoxazol-3-Amine

5-(Trifluoromethyl)-1,2-Benzoxazol-3-Amine

C8H5F3N2O (202.0354)


   

(2R)-3-(4-chlorophenoxy)propane-1,2-diol

(2R)-3-(4-chlorophenoxy)propane-1,2-diol

C9H11ClO3 (202.0397)


   

(2S)-3-(4-chlorophenoxy)propane-1,2-diol

(2S)-3-(4-chlorophenoxy)propane-1,2-diol

C9H11ClO3 (202.0397)


   

7-(2-Thienyl)[1,2,4]triazolo[4,3-a]pyrimidine

7-(2-Thienyl)[1,2,4]triazolo[4,3-a]pyrimidine

C9H6N4S (202.0313)


   

Methyl 4,4,4-trifluoro-3-hydroxy-3-methoxybutanoate

Methyl 4,4,4-trifluoro-3-hydroxy-3-methoxybutanoate

C6H9F3O4 (202.0453)


   

3-(3,3,3-Trifluoropropylsulfanyl)propanoic acid

3-(3,3,3-Trifluoropropylsulfanyl)propanoic acid

C6H9F3O2S (202.0275)


   

3-Methoxycarbonylmethyl-5-fluorouracil

3-Methoxycarbonylmethyl-5-fluorouracil

C7H7FN2O4 (202.039)


   

Xanthotoxol

2-Propenoic acid, 3-(6,7-dihydroxy-5-benzofuranyl)-, .delta.-lactone

C11H6O4 (202.0266)


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

7H-Furo(3,2-g)(1)benzopyran-7-one, 4-hydroxy- (8CI)(9CI)

C11H6O4 (202.0266)


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.

   

(2Z)-2-[3-(methylsulfanyl)propyl]but-2-enedioate

(2Z)-2-[3-(methylsulfanyl)propyl]but-2-enedioate

C8H10O4S-2 (202.03)


   

Tyrphostin A25

(3,4,5-Trihydroxybenzylidene)malononitrile

C10H6N2O3 (202.0378)


D000970 - Antineoplastic Agents > D020032 - Tyrphostins D004791 - Enzyme Inhibitors

   

2,4-Dimethylphenol sulfate

2,4-Dimethylphenol sulfate

C8H10O4S (202.03)


   

2,5-Dimethylphenol sulfate

2,5-Dimethylphenol sulfate

C8H10O4S (202.03)


   

chlorphenesin

chlorphenesin

C9H11ClO3 (202.0397)


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-carboxylic acid

C5H6N4O5 (202.0338)


   

3-ethylphenyl Sulfate

3-ethylphenyl Sulfate

C8H10O4S (202.03)


An aryl sulfate that is ethylbenzene substituted by a sulfooxy group at position 3.

   

4-ethylphenyl sulfate

4-ethylphenyl sulfate

C8H10O4S (202.03)


An aryl sulfate that is 4-ethylphenol in which the hydroxy group has been replaced by a sulfooxy group.

   

Ethylphenylsulfate

Ethylphenylsulfate

C8H10O4S (202.03)


   

1-(2,3-dihydro-2-furyl)-4-(thien-2-yl)but-1-en-3-yne

NA

C12H10OS (202.0452)


{"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

NA

C12H10OS (202.0452)


{"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"}

   

[5-(hept-5-en-1,3-diyn-1-yl)thiophen-2-yl]methanol

[5-(hept-5-en-1,3-diyn-1-yl)thiophen-2-yl]methanol

C12H10OS (202.0452)


   

2-(hydroxymethyl)-6-methanesulfinylbenzene-1,4-diol

2-(hydroxymethyl)-6-methanesulfinylbenzene-1,4-diol

C8H10O4S (202.03)


   

{5-[(5e)-hept-5-en-1,3-diyn-1-yl]thiophen-2-yl}methanol

{5-[(5e)-hept-5-en-1,3-diyn-1-yl]thiophen-2-yl}methanol

C12H10OS (202.0452)


   

5-(methylsulfanyl)-1-phenylpent-4-en-2-yn-1-one

5-(methylsulfanyl)-1-phenylpent-4-en-2-yn-1-one

C12H10OS (202.0452)


   

(4e)-5-(methylsulfanyl)-1-phenylpent-4-en-2-yn-1-one

(4e)-5-(methylsulfanyl)-1-phenylpent-4-en-2-yn-1-one

C12H10OS (202.0452)


   

(4z)-5-(methylsulfanyl)-1-phenylpent-4-en-2-yn-1-one

(4z)-5-(methylsulfanyl)-1-phenylpent-4-en-2-yn-1-one

C12H10OS (202.0452)


   

3-hydroxy-1,6-dimethyl-6-(methylsulfanyl)pyrazine-2,5-dione

3-hydroxy-1,6-dimethyl-6-(methylsulfanyl)pyrazine-2,5-dione

C7H10N2O3S (202.0412)


   

(6s)-3-hydroxy-1,6-dimethyl-6-(methylsulfanyl)pyrazine-2,5-dione

(6s)-3-hydroxy-1,6-dimethyl-6-(methylsulfanyl)pyrazine-2,5-dione

C7H10N2O3S (202.0412)