Exact Mass: 402.0827

Exact Mass Matches: 402.0827

Found 53 metabolites which its exact mass value is equals to given mass value 402.0827, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

4'-Phosphopantothenoylcysteine

(2R)-2-{3-[(2R)-2-hydroxy-3-methyl-3-[(phosphonooxy)methyl]butanamido]propanamido}-3-sulfanylpropanoic acid

C12H23N2O9PS (402.0862)


4-Phosphopantothenoylcysteine, also known as pantothenoylcysteine 4-phosphate, belongs to the class of organic compounds known as hybrid peptides. Hybrid peptides are compounds containing at least two different types of amino acids (alpha, beta, gamma, delta) linked to each other through a peptide bond. 4-Phosphopantothenoylcysteine is an extremely weak basic (essentially neutral) compound (based on its pKa). Within humans, 4-phosphopantothenoylcysteine participates in a number of enzymatic reactions. In particular, cytidine monophosphate and 4-phosphopantothenoylcysteine can be biosynthesized from cytidine triphosphate, D-4-phosphopantothenate, and L-cysteine through the action of the enzyme phosphopantothenate--cysteine ligase. 4-Phosphopantothenoylcysteine (PPC) is an intermediate in the biosynthetic machinery (pathway) that converts pantothenate (vitamin B5) into coenzyme A (CoA). The enzyme phosphopantothenoylcysteine decarboxylase catalyzes the decarboxylation of PPC into 4-phosphopantetheine. Coenzyme A is the principal acyl carrier and is required for many synthetic and degradative reactions in intermediary metabolism, and is an essential cofactor in all living systems (PMID: 15450493, 16371361, 14501115). 4-Phosphopantothenoylcysteine (PPC) is an intermediate in the biosynthetic machinery (pathway) that converts pantothenate (vitamin B5) into coenzyme A (CoA). The enzyme Phosphopantothenoylcysteine decarboxylase catalyzes the decarboxylation of PPC to 4-phosphopantetheine. Coenzyme A is the principal acyl carrier and is required for many synthetic and degradative reactions in intermediary metabolism, and is an essential cofactor in all living systems. (PMID: 15450493, 16371361, 14501115) [HMDB]

   

Mollicellin J

Mollicellin J

C21H19ClO6 (402.087)


   

Pritelivir

N-(5-(Aminiosulfonyl)-4-methyl-1,3-thiazol-2-yl)-N-methyl-2-(4-(2-pyridinyl)phenyl)acetamide

C18H18N4O3S2 (402.082)


D000890 - Anti-Infective Agents > D000998 - Antiviral Agents C254 - Anti-Infective Agent > C281 - Antiviral Agent D004791 - Enzyme Inhibitors

   

Psoberan

4-methoxy-7H-furo[3,2-g]chromen-7-one; 7H-furo[3,2-g]chromen-7-one

C23H14O7 (402.0739)


Psoberan can be found in fig, which makes psoberan a potential biomarker for the consumption of this food product. D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins

   

MCULE-9857824837

MCULE-9857824837

C21H19ClO6 (402.087)


   

Ethyl 2-cyano-3-[(2-ethoxy-2-oxoethyl)sulfanyl]-3-[2-(trifluoromethyl)anilino]acrylate

Ethyl 2-cyano-3-[(2-ethoxy-2-oxoethyl)sulfanyl]-3-[2-(trifluoromethyl)anilino]acrylate

C17H17F3N2O4S (402.0861)


   
   

MCULE-4495199001

MCULE-4495199001

C21H19ClO6 (402.087)


   
   
   
   

1-(alpha-Hydroxybenzyl)-3,7-dihydroxy-8-methoxy-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid 2,1-lactone

1-(alpha-Hydroxybenzyl)-3,7-dihydroxy-8-methoxy-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid 2,1-lactone

C23H14O7 (402.0739)


   

Pipoxide chlorohydrin

Pipoxide chlorohydrin

C21H19ClO6 (402.087)


   

C21H19ClO6_[5-(Benzoyloxy)-3-chloro-4,6-dihydroxy-1-cyclohexen-1-yl]methyl benzoate

NCGC00381300-01_C21H19ClO6_[5-(Benzoyloxy)-3-chloro-4,6-dihydroxy-1-cyclohexen-1-yl]methyl benzoate

C21H19ClO6 (402.087)


   

(5-benzoyloxy-3-chloro-4,6-dihydroxycyclohexen-1-yl)methyl benzoate

(5-benzoyloxy-3-chloro-4,6-dihydroxycyclohexen-1-yl)methyl benzoate

C21H19ClO6 (402.087)


   

(5-benzoyloxy-2-chloro-1,6-dihydroxycyclohex-3-en-1-yl)methyl benzoate

(5-benzoyloxy-2-chloro-1,6-dihydroxycyclohex-3-en-1-yl)methyl benzoate

C21H19ClO6 (402.087)


   
   
   
   

4-Phospho-N-pantothenoylcysteine

4-Phospho-N-pantothenoylcysteine

C12H23N2O9PS (402.0862)


   
   

Methicillin SodiuM

Methicillin SodiuM

C17H19N2NaO6S (402.0861)


D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams

   

(1R,2S)-1-Amino-N-(cyclopropylsulfonyl)-2-ethenylcyclopropanecarboxamide 4-methylbenzenesulfonate

(1R,2S)-1-Amino-N-(cyclopropylsulfonyl)-2-ethenylcyclopropanecarboxamide 4-methylbenzenesulfonate

C16H22N2O6S2 (402.0919)


   

5-(2-BENZOTHIAZOLYL)-1-(4-NITROPHENYL)-3-PHENYLFORMAZAN

5-(2-BENZOTHIAZOLYL)-1-(4-NITROPHENYL)-3-PHENYLFORMAZAN

C20H14N6O2S (402.0899)


   

4,4-SULFONYLBIS(PHENOXYBENZENE)

4,4-SULFONYLBIS(PHENOXYBENZENE)

C24H18O4S (402.0926)


   

Chloro(1,3-dimesitylimidazol-2-ylidene)copper(I)

Chloro(1,3-dimesitylimidazol-2-ylidene)copper(I)

C21H24ClCuN2 (402.0924)


   

1-(2-BROMOPHENYL)-5-ETHYL-3,4-DIPHENYL-1H-PYRAZOLE

1-(2-BROMOPHENYL)-5-ETHYL-3,4-DIPHENYL-1H-PYRAZOLE

C23H19BrN2 (402.0732)


   

(2S,4R)-2-METHYL 1-(4-NITROBENZYL) 4-((METHYLSULFONYL)OXY)PYRROLIDINE-1,2-DICARBOXYLATE

(2S,4R)-2-METHYL 1-(4-NITROBENZYL) 4-((METHYLSULFONYL)OXY)PYRROLIDINE-1,2-DICARBOXYLATE

C15H18N2O9S (402.0733)


   

(S)-5-(((4-((5-Chloropyridin-2-yl)oxy)piperidin-1-yl)sulfonyl)methyl)-5-methylimidazolidine-2,4-dione

(S)-5-(((4-((5-Chloropyridin-2-yl)oxy)piperidin-1-yl)sulfonyl)methyl)-5-methylimidazolidine-2,4-dione

C15H19ClN4O5S (402.0765)


   
   
   

S-3-(4-Fluorophenoxy)-2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide

S-3-(4-Fluorophenoxy)-2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide

C17H14F4N2O5 (402.0839)


   

(1S,6alpha)-1-(Benzoyloxy)methyl-6-chloro-4-cyclohexene-1beta,2beta,3alpha-triol 3-benzoate

(1S,6alpha)-1-(Benzoyloxy)methyl-6-chloro-4-cyclohexene-1beta,2beta,3alpha-triol 3-benzoate

C21H19ClO6 (402.087)


   

2,5-Bis(2-chloro-4-guanidinophenyl)furan

2,5-Bis(2-chloro-4-guanidinophenyl)furan

C18H16Cl2N6O (402.0763)


   

acs.jmedchem.1c00409_ST.421

acs.jmedchem.1c00409_ST.421

C18H16Cl2N6O (402.0763)


   

5-chloro-6-methyl-N-[2-(4-methylsulfonylphenyl)ethyl]-2-pyridin-2-ylpyrimidin-4-amine

5-chloro-6-methyl-N-[2-(4-methylsulfonylphenyl)ethyl]-2-pyridin-2-ylpyrimidin-4-amine

C19H19ClN4O2S (402.0917)


   

propanoyl-AMP(1-)

propanoyl-AMP(1-)

C13H17N5O8P- (402.0815)


An organophosphate oxoanion obtained by removal of the proton from the phosphate group of propanoyl-AMP; major species at pH 7.3

   

L-Phenylalanine, N-[[(3R)-5-chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl]carbonyl]-

L-Phenylalanine, N-[[(3R)-5-chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl]carbonyl]-

C20H17ClNO6- (402.0744)


   

2-[2-nitro-4-(trifluoromethyl)phenoxy]-N-phenylbenzamide

2-[2-nitro-4-(trifluoromethyl)phenoxy]-N-phenylbenzamide

C20H13F3N2O4 (402.0827)


   

2-[[5-[(2-Chloroanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester

2-[[5-[(2-Chloroanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester

C19H19ClN4O2S (402.0917)


   

4-[[2-[(4-Methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester

4-[[2-[(4-Methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester

C18H18N4O3S2 (402.082)


   

N-[3-(dimethylsulfamoyl)phenyl]-2-(4-quinazolinylthio)acetamide

N-[3-(dimethylsulfamoyl)phenyl]-2-(4-quinazolinylthio)acetamide

C18H18N4O3S2 (402.082)


   

4,5-Dioxo-2-phenyl-1-(4-sulfamoylphenyl)-3-pyrrolidinecarboxylic acid ethyl ester

4,5-Dioxo-2-phenyl-1-(4-sulfamoylphenyl)-3-pyrrolidinecarboxylic acid ethyl ester

C19H18N2O6S (402.0886)


   

N-[(R)-4-phosphopantothenoyl]-L-cysteine

N-[(R)-4-phosphopantothenoyl]-L-cysteine

C12H23N2O9PS (402.0862)


The N-[(R)-4-phosphopantothenoyl] derivative of L-cysteine.

   

ochratoxin A(1-)

ochratoxin A(1-)

C20H17ClNO6 (402.0744)


A monocarboxylic acid anion that is conjugate base of ochratoxin A, arising from the deprotonation of the carboxy group. Major microspecies at pH 7.3.

   

Mollicellin J

Mollicellin J

C21H19ClO6 (402.087)


A member of the class of depsidones that is 11H-dibenzo[b,e][1,4]dioxepine substituted by a chloro group at position 2, hydroxy groups at position 3 and 7, methyl group at positions 1 and 9, a prenyl group at position 8, an oxo group at position 11 and a formyl group at position 4. Isolated from Chaetomium brasiliense it exhibits cytotoxic activity.

   

A-867744

A-867744

C20H19ClN2O3S (402.0805)


A-867744 is a highly potent and selective type II positive allosteric modulator (PAM) of the alpha7 nicotinic acetylcholine receptors (nAChR) with an EC50 of 1.0 μM[1].

   

AP521

AP521

C20H19ClN2O3S (402.0805)


AP521 is an agonist of human 5-HT1A receptor with an IC50 of 94 nM.

   

(1r)-4,9-dihydroxy-10-methoxy-1-phenyl-1h-anthra[1,2-c]furan-3,6,11-trione

(1r)-4,9-dihydroxy-10-methoxy-1-phenyl-1h-anthra[1,2-c]furan-3,6,11-trione

C23H14O7 (402.0739)


   

(2r)-2-[(3-{[(2r)-1,2-dihydroxy-3,3-dimethyl-4-(phosphonooxy)butylidene]amino}-1-hydroxypropylidene)amino]-3-sulfanylpropanoic acid

(2r)-2-[(3-{[(2r)-1,2-dihydroxy-3,3-dimethyl-4-(phosphonooxy)butylidene]amino}-1-hydroxypropylidene)amino]-3-sulfanylpropanoic acid

C12H23N2O9PS (402.0862)


   

2-chloro-7-[(1e)-hex-1-en-1-yl]-1,6,8-trihydroxy-3-methoxyanthracene-9,10-dione

2-chloro-7-[(1e)-hex-1-en-1-yl]-1,6,8-trihydroxy-3-methoxyanthracene-9,10-dione

C21H19ClO6 (402.087)


   

2-chloro-7-(hex-1-en-1-yl)-1,6,8-trihydroxy-3-methoxyanthracene-9,10-dione

2-chloro-7-(hex-1-en-1-yl)-1,6,8-trihydroxy-3-methoxyanthracene-9,10-dione

C21H19ClO6 (402.087)


   

(1r,4s,5s,6s)-5-[(benzoyloxy)methyl]-4-chloro-5,6-dihydroxycyclohex-2-en-1-yl benzoate

(1r,4s,5s,6s)-5-[(benzoyloxy)methyl]-4-chloro-5,6-dihydroxycyclohex-2-en-1-yl benzoate

C21H19ClO6 (402.087)