Exact Mass: 639.1317

Exact Mass Matches: 639.1317

Found 26 metabolites which its exact mass value is equals to given mass value 639.1317, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

CMP-pseudaminic acid

CMP-pseudaminic acid

C22H34N5O15P (639.1789)


   

CMP-N,N-diacetyllegionaminic acid

CMP-N,N-diacetyllegionaminic acid

C22H34N5O15P (639.1789)


   
   

Malvidin 3-(6-coumaroylglucoside)

5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-{[3,4,5-trihydroxy-6-({[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}-1lambda4-chromen-1-ylium

C32H31O14 (639.1714)


Malvidin 3-(6-coumaroylglucoside) is found in alcoholic beverages. Malvidin 3-(6-coumaroylglucoside) is a pigment of skins of black grapes, found in red wine. Pigment of skins of black grapes, found in red wine

   

Malvidin 3-glucoside-4-vinylguaiacol

11-hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2λ⁴,8-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),2,4,6,9,11-hexaen-2-ylium

C32H31O14+ (639.1714)


Malvidin 3-glucoside-4-vinylguaiacol is found in alcoholic beverages. Malvidin 3-glucoside-4-vinylguaiacol is a pigment isolated from various red wines [CCD]. Pigment isolated from various red wines [CCD]. Malvidin 3-glucoside-4-vinylguaiacol is found in alcoholic beverages and common grape.

   

N-Trifluoroacetyladriamycin

2,2,2-trifluoro-N-[(2S,3S,4S,6R)-3-hydroxy-2-methyl-6-{[(1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl]oxy}oxan-4-yl]acetamide

C29H28F3NO12 (639.1564)


N-Trifluoroacetyladriamycin is a metabolite of valrubicin. Valrubicin (N-trifluoroacetyladriamycin-14-valerate, trade name Valstar) is a chemotherapy drug used to treat bladder cancer. Valrubicin is a semisynthetic analog of the anthracycline doxorubicin, and is administered by infusion directly into the bladder. It was originally launched as Valstar in the U.S. (Wikipedia)

   

Malvidin 3-(6'-p-coumarylglucoside)

5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium

C32H31O14 (639.1714)


Malvidin 3-(6-p-coumarylglucoside) is a member of the class of compounds known as flavonoid 3-o-p-coumaroyl glycosides. Flavonoid 3-o-p-coumaroyl glycosides are flavonoid 3-O-glycosides where the carbohydrate moiety is esterified with a p-coumaric acid. P-coumaric acid is an organic derivative of cinnamic acid, that carries a hydroxyl group at the 4-position of the benzene ring. Malvidin 3-(6-p-coumarylglucoside) is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Malvidin 3-(6-p-coumarylglucoside) can be synthesized from cis-4-coumaric acid. Malvidin 3-(6-p-coumarylglucoside) can also be synthesized into malvidin. Malvidin 3-(6-p-coumarylglucoside) can be found in common grape and grape, which makes malvidin 3-(6-p-coumarylglucoside) a potential biomarker for the consumption of these food products. Malvidin 3-(6-p-coumarylglucoside) may be a unique S.cerevisiae (yeast) metabolite.

   

Malvidin 3-(6-p-coumarylglucoside)

3,5,7,4-Tetrahydroxy-3,5-dimethoxyflavylium 3- (6"-p-coumarylglucoside)

C32H31O14 (639.1714)


   

Carboxyltolmetin Diglucuronide

Carboxyltolmetin Diglucuronide

C27H29NO17 (639.1435)


   

Malvidin 3-(6-coumaroylglucoside)

5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-{[3,4,5-trihydroxy-6-({[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}-1$l^{4}-chromen-1-ylium

C32H31O14 (639.1714)


   

Malvidin 3-(6-p-coumarylglucoside)

Malvidin 3-(6-p-coumarylglucoside)

C32H31O14+ (639.1714)


   

Malvidin 3-glucoside-4-vinylguaiacol

Malvidin 3-glucoside-4-vinylguaiacol

C32H31O14+ (639.1714)


   

(tetraaminophthalocyaninato)oxovanadium(iv)

(tetraaminophthalocyaninato)oxovanadium(iv)

C32H20N12OV (639.1323)


   

Elzasonan citrate

Elzasonan citrate

C28H31Cl2N3O8S (639.1209)


C78272 - Agent Affecting Nervous System > C66885 - Serotonin Antagonist

   

5-Acetamido-6-(1-acetamido-2-hydroxypropyl)-2-[[5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-hydroxyoxane-2-carboxylic acid

5-Acetamido-6-(1-acetamido-2-hydroxypropyl)-2-[[5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-hydroxyoxane-2-carboxylic acid

C22H34N5O15P (639.1789)


   

CMP-5,7-Di-N-acetyl-acinetaminic acid

CMP-5,7-Di-N-acetyl-acinetaminic acid

C22H34N5O15P (639.1789)


   

Malvidin 3-(6-coumaroylglucoside)

Malvidin 3-(6-coumaroylglucoside)

C32H31O14+ (639.1714)


   

HNK-1 carbohydrate epitope

HNK-1 carbohydrate epitope

C20H33NO20S (639.1317)


   

Malvidin-3-O-(6-p-coumaroyl)glucoside

Malvidin-3-O-(6-p-coumaroyl)glucoside

C32H31O14+ (639.1714)


   

Malvidin-3-O-(6-O-cis-p-coumaryl-beta-D-glucoside)

Malvidin-3-O-(6-O-cis-p-coumaryl-beta-D-glucoside)

C32H31O14+ (639.1714)


   

4-chloro-N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]benzenesulfonamide

4-chloro-N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]benzenesulfonamide

C30H33ClF3N3O5S (639.1781)


   

4-O-(2-acetamido-2-deoxy-alpha-D-glucosylphospho)-2-acetamido-2-deoxy-alpha-D-glucosyl 3-aminopropyl phosphate(2-)

4-O-(2-acetamido-2-deoxy-alpha-D-glucosylphospho)-2-acetamido-2-deoxy-alpha-D-glucosyl 3-aminopropyl phosphate(2-)

C19H35N3O17P2-2 (639.1442)


   

GlcA3S(b1-3)Gal(b1-4)b-GlcNAc

GlcA3S(b1-3)Gal(b1-4)b-GlcNAc

C20H33NO20S (639.1317)


   

malvidin 3-O-(6-O-(E)-4-coumaroyl-beta-D-glucoside)

malvidin 3-O-(6-O-(E)-4-coumaroyl-beta-D-glucoside)

C32H31O14 (639.1714)


An anthocyanin cation that is malvidin substituted at position 3 by a 6-O-(trans-4 coumaryl)-beta-D-glucosyl residue

   

malvidin 3-O-(6-O-(Z)-4-coumaroyl-beta-D-glucoside)

malvidin 3-O-(6-O-(Z)-4-coumaroyl-beta-D-glucoside)

C32H31O14 (639.1714)


An anthocyanin cation that is malvidin substituted at position 3 by a 6-O-(cis-4 coumaryl)-beta-D-glucosyl residue.

   

MRS-3777 (hemioxalate)

MRS-3777 (hemioxalate)

C17H19N5O.1/2C2H2O4 (639.1543)


MRS-3777 hemioxalate is a selective adenosine A3 receptor antagonist[1].