Exact Mass: 352.0804586

Exact Mass Matches: 352.0804586

Found 86 metabolites which its exact mass value is equals to given mass value 352.0804586, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

4-Methylumbelliferone glucuronide

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid

C16H16O9 (352.0794286)


D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D049408 - Luminescent Agents D004396 - Coloring Agents > D005456 - Fluorescent Dyes

   

Griseofulvin

(2S,6R)-7-chloro-2,4,6-trimethoxy-6-methyl-3H-spiro[1-benzofuran-2,1-cyclohexan]-2-ene-3,4-dione

C17H17ClO6 (352.0713612)


Griseofulvin is only found in individuals that have used or taken this drug. It is an antifungal antibiotic. Griseofulvin may be given by mouth in the treatment of tinea infections. [PubChem]Griseofulvin is fungistatic, however the exact mechanism by which it inhibits the growth of dermatophytes is not clear. It is thought to inhibit fungal cell mitosis and nuclear acid synthesis. It also binds to and interferes with the function of spindle and cytoplasmic microtubules by binding to alpha and beta tubulin. It binds to keratin in human cells, then once it reaches the fungal site of action, it binds to fungal microtubes thus altering the fungal process of mitosis. D - Dermatologicals > D01 - Antifungals for dermatological use > D01B - Antifungals for systemic use > D01BA - Antifungals for systemic use D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use > D01AA - Antibiotics D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C254 - Anti-Infective Agent > C514 - Antifungal Agent Griseofulvin(Gris-PEG; Grifulvin) is a spirocyclic fungal natural product used in treatment of fungal dermatophytes; Antifungal drug.

   

7-Hydroxymethyl-12-methylbenz[a]anthracene sulfate

7-Hydroxymethyl-12-methylbenz[a]anthracene sulphuric acid

C20H16O4S (352.07692560000004)


This compound belongs to the family of Phenanthrenes and Derivatives. These are polycyclic compounds containing a phenanthrene moiety, which is a tricyclic aromatic compound with three non-linearly fused benzene.

   

4-Methylumbelliferylglucuronide

4-Methylumbelliferyl alpha-L-iduronide (free acid)

C16H16O9 (352.0794286)


   

Chlorogenoquinone

3-{[(2Z)-3-(3,4-dioxocyclohexa-1,5-dien-1-yl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexane-1-carboxylic acid

C16H16O9 (352.0794286)


Forms coloured adducts with amino acids and peptides, implicated in food discolouration. Chlorogenoquinone is found in many foods, some of which are wild carrot, carrot, blackcurrant, and pear. Chlorogenoquinone is found in blackcurrant. Chlorogenoquinone forms coloured adducts with amino acids and peptides, implicated in food discolouratio

   

Decarbamoylgonyautoxin III

[10,10-dihydroxy-4-(hydroxymethyl)-2,6-diimino-hexahydro-1H-pyrrolo[1,2-c]purin-9-yl]oxidanesulfonic acid

C9H16N6O7S (352.0801146)


Decarbamoylgonyautoxin II is found in mollusks. Decarbamoylgonyautoxin II is isolated from various shellfish. Isolated from various shellfish. Decarbamoylgonyautoxin III is found in mollusks.

   

N-(Carbethoxyacetyl)-4-chloro-L-tryptophan

3-(4-chloro-1H-indol-3-yl)-2-[(Z)-(3-ethoxy-1-hydroxy-3-oxopropylidene)amino]propanoic acid

C16H17ClN2O5 (352.0825942)


N-(Carbethoxyacetyl)-4-chloro-L-tryptophan is found in pulses. N-(Carbethoxyacetyl)-4-chloro-L-tryptophan is isolated from Pisum sativum (pea Isolated from Pisum sativum (pea). N-(Carbethoxyacetyl)-4-chloro-L-tryptophan is found in pulses and common pea.

   

Acetamide, N-(4-(((2,6-dimethoxy-4-pyrimidinyl)amino)sulfonyl)phenyl)-

Acetamide, N-(4-(((2,6-dimethoxy-4-pyrimidinyl)amino)sulfonyl)phenyl)-

C14H16N4O5S (352.0841366)


   

4-Methyl-2-oxo-2H-1-benzopyran-7-yl alpha-L-ido-pyranosiduronic acid

3,4,5-trihydroxy-6-[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]oxane-2-carboxylic acid

C16H16O9 (352.0794286)


   

N(4)-Acetylsulfadimethoxine

N-{4-[(4,6-dimethoxypyrimidin-2-yl)sulphamoyl]phenyl}ethanimidic acid

C14H16N4O5S (352.0841366)


D000890 - Anti-Infective Agents > D013424 - Sulfanilamides

   

N4-Acetyl Sulfadoxine

N-{4-[(5,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}acetamide

C14H16N4O5S (352.0841366)


D000890 - Anti-Infective Agents > D013424 - Sulfanilamides

   

Gris-PEG

7-chloro-2,4,6-trimethoxy-6-methyl-3H-spiro[1-benzofuran-2,1-cyclohexan]-2-ene-3,4-dione

C17H17ClO6 (352.0713612)


   

alpha-N-Carboethoxyacetyl-4-chloro-D-tryptophan

(2R)-3-(4-Chloro-1H-indol-3-yl)-2-[(3-ethoxy-1-hydroxy-3-oxopropylidene)amino]propanoate

C16H17ClN2O5 (352.0825942)


Alpha-n-carboethoxyacetyl-4-chloro-d-tryptophan is a member of the class of compounds known as N-acyl-alpha amino acids. N-acyl-alpha amino acids are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom. Alpha-n-carboethoxyacetyl-4-chloro-d-tryptophan is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Alpha-n-carboethoxyacetyl-4-chloro-d-tryptophan can be found in common pea, which makes alpha-n-carboethoxyacetyl-4-chloro-d-tryptophan a potential biomarker for the consumption of this food product.

   

5-O-(3-Chloro-2-hydroxy-3-methylbutyl)-8-methoxypsoralen

5-O-(3-Chloro-2-hydroxy-3-methylbutyl)-8-methoxypsoralen

C17H17ClO6 (352.0713612)


   

alpha-N-Carboethoxyacetyl-D-4-chlorotryptophan

alpha-N-Carboethoxyacetyl-D-4-chlorotryptophan

C16H17ClN2O5 (352.0825942)


   
   

N(4)-Acetylsulfadimethoxine

N(4)-Acetylsulfadimethoxine

C14H16N4O5S (352.0841366)


A sulfonamide that is benzenesulfonamide substituted by an acetylamino group at position 4 and a 4,6-dimethoxy-pyrimidin-2-yl group at the nitrogen atom. It is a metabolite of the sulfonamide antibiotic sulfadimethoxine. D000890 - Anti-Infective Agents > D013424 - Sulfanilamides

   
   

4-hydroxybostrycin

4-hydroxybostrycin

C16H16O9 (352.0794286)


   

7-chloro-2,5,6-trimethoxy-6-methylspiro(benzofuran-2(3H),1-(2)cyclohexene)-3,4-dione|7-chloro-2,5,6-trimethoxy-6-methylspiro[benzofuran-2(3H),1-(2)cyclohexene]-3,4-dione

7-chloro-2,5,6-trimethoxy-6-methylspiro(benzofuran-2(3H),1-(2)cyclohexene)-3,4-dione|7-chloro-2,5,6-trimethoxy-6-methylspiro[benzofuran-2(3H),1-(2)cyclohexene]-3,4-dione

C17H17ClO6 (352.0713612)


   
   
   

N-malonyl(methyl ester)-4-Cl-L-tryptophan methyl ester

N-malonyl(methyl ester)-4-Cl-L-tryptophan methyl ester

C16H17ClN2O5 (352.0825942)


   

Tetra-Ac-6-Hydroxymethyl-2,3,4-trihydroxybenzaldehyde

Tetra-Ac-6-Hydroxymethyl-2,3,4-trihydroxybenzaldehyde

C16H16O9 (352.0794286)


   

4-(2-Hydroxy-3-chloro-3-methylbutoxy)-9-methoxy-7H-furo[3,2-g][1]benzopyran-7-one

4-(2-Hydroxy-3-chloro-3-methylbutoxy)-9-methoxy-7H-furo[3,2-g][1]benzopyran-7-one

C17H17ClO6 (352.0713612)


   

4-Methoxy-9-(2-hydroxy-3-methyl-3-chlorobutoxy)-7H-furo[3,2-g][1]benzopyran-7-one

4-Methoxy-9-(2-hydroxy-3-methyl-3-chlorobutoxy)-7H-furo[3,2-g][1]benzopyran-7-one

C17H17ClO6 (352.0713612)


   

N4-Acetylsulfadimethoxine

N(4)-Acetylsulfadimethoxine

C14H16N4O5S (352.0841366)


D000890 - Anti-Infective Agents > D013424 - Sulfanilamides CONFIDENCE standard compound; EAWAG_UCHEM_ID 245 CONFIDENCE standard compound; INTERNAL_ID 2011

   

4-Methylumbelliferylglucuronide

4-Methylumbelliferone glucuronide

C16H16O9 (352.0794286)


D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D049408 - Luminescent Agents D004396 - Coloring Agents > D005456 - Fluorescent Dyes relative retention time with respect to 9-anthracene Carboxylic Acid is 0.488 Acquisition and generation of the data is financially supported by the Max-Planck-Society IPB_RECORD: 2121; CONFIDENCE confident structure

   

Griseofulvin

Griseofulvin

C17H17ClO6 (352.0713612)


An oxaspiro compound produced by Penicillium griseofulvum. It is used by mouth as an antifungal drug for infections involving the scalp, hair, nails and skin that do not respond to topical treatment. D - Dermatologicals > D01 - Antifungals for dermatological use > D01B - Antifungals for systemic use > D01BA - Antifungals for systemic use D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use > D01AA - Antibiotics D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C254 - Anti-Infective Agent > C514 - Antifungal Agent CONFIDENCE Reference Standard (Level 1) relative retention time with respect to 9-anthracene Carboxylic Acid is 1.075 Griseofulvin(Gris-PEG; Grifulvin) is a spirocyclic fungal natural product used in treatment of fungal dermatophytes; Antifungal drug.

   

4-Methylumbelliferyl glucuronide

4-Methylumbelliferyl glucuronide

C16H16O9 (352.0794286)


CONFIDENCE standard compound; INTERNAL_ID 8327

   

C17H17ClO6_(2R,6R)-7-Chloro-2,4,6-trimethoxy-6-methyl-3H,4H-spiro[1-benzofuran-2,1-cyclohex[2]ene]-3,4-dione

NCGC00380657-01_C17H17ClO6_(2R,6R)-7-Chloro-2,4,6-trimethoxy-6-methyl-3H,4H-spiro[1-benzofuran-2,1-cyclohex[2]ene]-3,4-dione

C17H17ClO6 (352.0713612)


   

Chlorogenoquinone (Not validated)

Chlorogenoquinone (Not validated)

C16H16O9 (352.0794286)


Annotation level-3

   
   

Ala Cys Cys Gly

2-[(2R)-2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]acetic acid

C11H20N4O5S2 (352.087507)


   

Ala Cys Gly Cys

(2R)-2-{2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]acetamido}-3-sulfanylpropanoic acid

C11H20N4O5S2 (352.087507)


   

Ala Gly Cys Cys

(2R)-2-[(2R)-2-{2-[(2S)-2-aminopropanamido]acetamido}-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C11H20N4O5S2 (352.087507)


   

Cys Ala Cys Gly

2-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]-3-sulfanylpropanamido]acetic acid

C11H20N4O5S2 (352.087507)


   

Cys Ala Gly Cys

(2R)-2-{2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]acetamido}-3-sulfanylpropanoic acid

C11H20N4O5S2 (352.087507)


   

Cys Cys Ala Gly

2-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]propanamido]acetic acid

C11H20N4O5S2 (352.087507)


   

Cys Cys Gly Ala

(2S)-2-{2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]acetamido}propanoic acid

C11H20N4O5S2 (352.087507)


   

Cys Gly Ala Cys

(2R)-2-[(2S)-2-{2-[(2R)-2-amino-3-sulfanylpropanamido]acetamido}propanamido]-3-sulfanylpropanoic acid

C11H20N4O5S2 (352.087507)


   

Cys Gly Cys Ala

(2S)-2-[(2R)-2-{2-[(2R)-2-amino-3-sulfanylpropanamido]acetamido}-3-sulfanylpropanamido]propanoic acid

C11H20N4O5S2 (352.087507)


   

Gly Ala Cys Cys

(2R)-2-[(2R)-2-[(2S)-2-(2-aminoacetamido)propanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C11H20N4O5S2 (352.087507)


   

Gly Cys Ala Cys

(2R)-2-[(2S)-2-[(2R)-2-(2-aminoacetamido)-3-sulfanylpropanamido]propanamido]-3-sulfanylpropanoic acid

C11H20N4O5S2 (352.087507)


   

Gly Cys Cys Ala

(2S)-2-[(2R)-2-[(2R)-2-(2-aminoacetamido)-3-sulfanylpropanamido]-3-sulfanylpropanamido]propanoic acid

C11H20N4O5S2 (352.087507)


   
   
   
   
   

Chlorogenoquinone

3-{[(2Z)-3-(3,4-dioxocyclohexa-1,5-dien-1-yl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexane-1-carboxylic acid

C16H16O9 (352.0794286)


   

N-(Carbethoxyacetyl)-4-chloro-L-tryptophan

3-(4-chloro-1H-indol-3-yl)-2-(3-ethoxy-3-oxopropanamido)propanoic acid

C16H17ClN2O5 (352.0825942)


   

Decarbamoylgonyautoxin III

Decarbamoylgonyautoxin III

C9H16N6O7S (352.0801146)


   

2-Methyl-2-propanyl [2-(5-bromo-2-methyl-1H-indol-3-yl)ethyl]carb amate

2-Methyl-2-propanyl [2-(5-bromo-2-methyl-1H-indol-3-yl)ethyl]carb amate

C16H21BrN2O2 (352.0786306)


   

Ethyl 4-acetoxy-7-chloro-5,8-dimethoxy-2-naphthoate

Ethyl 4-acetoxy-7-chloro-5,8-dimethoxy-2-naphthoate

C17H17ClO6 (352.0713612)


   

NB-caged Tyrosine hydrochloride

NB-caged Tyrosine hydrochloride

C16H17ClN2O5 (352.0825942)


   

METHYL 4-(4-FLUOROPHENYL)-6-ISOPROPYL-2-(METHYLSULFONYL)PYRIMIDINE-5-CARBOXYLATE

METHYL 4-(4-FLUOROPHENYL)-6-ISOPROPYL-2-(METHYLSULFONYL)PYRIMIDINE-5-CARBOXYLATE

C16H17FN2O4S (352.08930140000007)


   

1-Chloro-3-(triphenylphosphoranylidene)acetone

1-Chloro-3-(triphenylphosphoranylidene)acetone

C21H18ClOP (352.0783738)


   

2-ACETAMINDO-2-(7-CHLOROINDOL-3-YLMETHYL)PROPANEDIOIC ACID DIMETHYL ESTER

2-ACETAMINDO-2-(7-CHLOROINDOL-3-YLMETHYL)PROPANEDIOIC ACID DIMETHYL ESTER

C16H17ClN2O5 (352.0825942)


   

2-(3-Bromo-5-(cyclopropylmethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(3-Bromo-5-(cyclopropylmethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C16H22BBrO3 (352.0845272)


   

2-benzofuran-1,3-dione,furan-2,5-dione,2-(2-hydroxyethoxy)ethanol

2-benzofuran-1,3-dione,furan-2,5-dione,2-(2-hydroxyethoxy)ethanol

C16H16O9 (352.0794286)


   

3,4-bis(phenylmethoxy)benzoyl chloride

3,4-bis(phenylmethoxy)benzoyl chloride

C21H17ClO3 (352.0866162)


   

4-Thiazolecarboxylic acid, 2-[(2,4,5-trimethoxybenzoyl)amino]-,methylester

4-Thiazolecarboxylic acid, 2-[(2,4,5-trimethoxybenzoyl)amino]-,methylester

C15H16N2O6S (352.0729036)


   

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-methyl-2-oxochromen-7-yl)oxyoxane-2-carboxylic acid

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-methyl-2-oxochromen-7-yl)oxyoxane-2-carboxylic acid

C16H16O9 (352.0794286)


   

3-[(4-Anilinophenyl)diazenyl]benzene-1-sulfonate

3-[(4-Anilinophenyl)diazenyl]benzene-1-sulfonate

C18H14N3O3S- (352.0755834)


   

5-[8-(1H-pyrazol-4-yl)-1,5-naphthyridin-2-yl]pyridine-3-sulfonamide

5-[8-(1H-pyrazol-4-yl)-1,5-naphthyridin-2-yl]pyridine-3-sulfonamide

C16H12N6O2S (352.0742412)


   
   

4-Methyl-2-oxo-2H-1-benzopyran-7-yl beta-D-galactopyranosiduronic acid

4-Methyl-2-oxo-2H-1-benzopyran-7-yl beta-D-galactopyranosiduronic acid

C16H16O9 (352.0794286)


   

3,4-dimethyl-N-[sulfanylidene-[2-(trifluoromethyl)anilino]methyl]benzamide

3,4-dimethyl-N-[sulfanylidene-[2-(trifluoromethyl)anilino]methyl]benzamide

C17H15F3N2OS (352.0857136)


   

2-(2-furyl)-3-{[(1E)-2-furylmethylene]amino}-7-nitro-2,3-dihydroquinazolin-4(1H)-one

2-(2-furyl)-3-{[(1E)-2-furylmethylene]amino}-7-nitro-2,3-dihydroquinazolin-4(1H)-one

C17H12N4O5 (352.0807662)


   

N-(2-fluorophenyl)-2-[2-(4-thiazolyl)-1-benzimidazolyl]acetamide

N-(2-fluorophenyl)-2-[2-(4-thiazolyl)-1-benzimidazolyl]acetamide

C18H13FN4OS (352.079406)


   

2-Amino-9-(4-fluorophenyl)-4-methyl-7-oxo-6,7,8,9-tetrahydrothieno[2,3-b:4,5-b]dipyridine-3-carbonitrile

2-Amino-9-(4-fluorophenyl)-4-methyl-7-oxo-6,7,8,9-tetrahydrothieno[2,3-b:4,5-b]dipyridine-3-carbonitrile

C18H13FN4OS (352.079406)


   

2-[[[5-Methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzothiazole

2-[[[5-Methyl-4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzothiazole

C18H16N4S2 (352.0816336)


   

2-[[(4-Ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1,3-benzothiazole

2-[[(4-Ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1,3-benzothiazole

C18H16N4S2 (352.0816336)


   
   
   

2-(2,3-dihydro-1H-inden-5-ylamino)-8-fluoro-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one

2-(2,3-dihydro-1H-inden-5-ylamino)-8-fluoro-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one

C18H13FN4OS (352.079406)


   
   

6-[[1-[(4-Fluorophenyl)methyl]-2-pyrrolyl]methylidene]-5-imino-7-thiazolo[3,2-a]pyrimidinone

6-[[1-[(4-Fluorophenyl)methyl]-2-pyrrolyl]methylidene]-5-imino-7-thiazolo[3,2-a]pyrimidinone

C18H13FN4OS (352.079406)


   

4-acetamido-N-(2-hydroxy-5-thiophen-2-ylphenyl)benzamide

4-acetamido-N-(2-hydroxy-5-thiophen-2-ylphenyl)benzamide

C19H16N2O3S (352.08815860000004)


   

3,4,5-Trihydroxy-6-[(1-oxoisochromen-3-yl)methoxy]oxane-2-carboxylic acid

3,4,5-Trihydroxy-6-[(1-oxoisochromen-3-yl)methoxy]oxane-2-carboxylic acid

C16H16O9 (352.0794286)


   

3,4,5-Trihydroxy-6-(6-methyl-2-oxochromen-7-yl)oxyoxane-2-carboxylic acid

3,4,5-Trihydroxy-6-(6-methyl-2-oxochromen-7-yl)oxyoxane-2-carboxylic acid

C16H16O9 (352.0794286)


   

Chlorogenic acid quinone

Chlorogenic acid quinone

C16H16O9 (352.0794286)


   

7-Hydroxymethyl-12-methylbenz[a]anthracene sulfate

7-Hydroxymethyl-12-methylbenz[a]anthracene sulfate

C20H16O4S (352.07692560000004)


   

N(4)-Acetylsulfadoxine

N(4)-Acetylsulfadoxine

C14H16N4O5S (352.0841366)


D000890 - Anti-Infective Agents > D013424 - Sulfanilamides

   

4-methylumbelliferone beta-D-glucuronide

4-methylumbelliferone beta-D-glucuronide

C16H16O9 (352.0794286)


A beta-D-glucosiduronic acid having a 4-methylumbelliferyl substituent at the anomeric position.

   

Methylumbelliferyl glucuronide

Methylumbelliferyl glucuronide

C16H16O9 (352.0794286)