Exact Mass: 682.127507

Exact Mass Matches: 682.127507

Found 57 metabolites which its exact mass value is equals to given mass value 682.127507, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Tricin 7-diglucuronoside

5-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-3,4-dihydroxy-6-{[5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxane-2-carboxylic acid

C29H30O19 (682.138123)


Tricin 7-diglucuronoside is found in pulses. Tricin 7-diglucuronoside is isolated from alfalfa (Medicago sativa).

   

8-Hydroxyhesperetin 7-[6-acetylglucosyl-(1->2)-glucoside]

{6-[(2-{[5,8-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methyl acetic acid

C30H34O18 (682.1745064)


8-Hydroxyhesperetin 7-[6-acetylglucosyl-(1->2)-glucoside] is found in tea. 8-Hydroxyhesperetin 7-[6-acetylglucosyl-(1->2)-glucoside] is a constituent of Sideritis syriaca (Greek mountain tea). Constituent of Sideritis syriaca (Greek mountain tea). 8-Hydroxyhesperetin 7-[6-acetylglucosyl-(1->2)-glucoside] is found in tea.

   
   

2)-glucoside

5,7,8,3-Tetrahydroxy-4-methoxyflavone 7- (6"-acetylallosyl- (1->2) -glucoside

C30H34O18 (682.1745064)


   

3)-galactoside

3- [ [ 3-O- (6-O-Acetyl-beta-D-glucopyranosyl) -beta-D-galactopyranosyl ] oxy ] -5,7-dihydroxy-2- (4-hydroxy-3-methoxyphenyl) -4H-1-benzopyran-4-one

C30H34O18 (682.1745064)


   

Kaempferol 3-(2-hydroxypropionylglucoside)-4-glucoside

3,5,7,4-Tetrahydroxyflavone 3- (2"-hydroxypropionylglucoside) -4-glucoside

C30H34O18 (682.1745064)


   

Isorhamnetin 3-(6-acetylglucosyl)(1->6)-galactoside

Isorhamnetin 3-(6-acetylglucosyl)(1->6)-galactoside

C30H34O18 (682.1745064)


   

Isorhamnetin 3- (6'-acetylglucosyl) (1->6) -galactoside

3,4,5,7-Tetrahydroxy-3-methoxyflavone 3- (6"-acetylglucosyl) (1->6) -galactoside

C30H34O18 (682.1745064)


   

[(2R,3S,4S,5R,6S)-3,4-dihydroxy-6-[3,7,8-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-5-yl]oxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methyl acetate

[(2R,3S,4S,5R,6S)-3,4-dihydroxy-6-[3,7,8-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-5-yl]oxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methyl acetate

C30H34O18 (682.1745064)


   

7-O-[(6-O-acetyl)-beta-D-allopyranosyl-(1->2)-beta-D-glucopyranosyl]hypolaetin-3-methyl ether

7-O-[(6-O-acetyl)-beta-D-allopyranosyl-(1->2)-beta-D-glucopyranosyl]hypolaetin-3-methyl ether

C30H34O18 (682.1745064)


   

isorhamnetin 3-O-[2-O-acetyl-beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranoside]

isorhamnetin 3-O-[2-O-acetyl-beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranoside]

C30H34O18 (682.1745064)


   

7-O-Diglucuronoside-4,5,7-Trihydroxy-3,5-dimethoxyflavone

7-O-Diglucuronoside-4,5,7-Trihydroxy-3,5-dimethoxyflavone

C29H30O19 (682.138123)


   

Tri-Ac-Fusccofusarin

Tri-Ac-Fusccofusarin

C37H30O13 (682.168633)


   

7-hydroxyeckol hepta-acetate

7-hydroxyeckol hepta-acetate

C32H26O17 (682.1169946)


   

3-hydroxy-4-O-methyl-isoscutellarein 7-O-[6-acetyl-beta-D-allopyranosyl-(1?2)-beta-D-glucopyranoside]

3-hydroxy-4-O-methyl-isoscutellarein 7-O-[6-acetyl-beta-D-allopyranosyl-(1?2)-beta-D-glucopyranoside]

C30H34O18 (682.1745064)


   

Acetylspectabiflaside

Acetylspectabiflaside

C30H34O18 (682.1745064)


   

isoscutellarein 4-methyl ether 7-O-(6-O-acetyl)-beta-allopyranosyl(1->2)-beta-glucopyranoside

isoscutellarein 4-methyl ether 7-O-(6-O-acetyl)-beta-allopyranosyl(1->2)-beta-glucopyranoside

C30H34O18 (682.1745064)


   

Isorhamnetin 3-(6-acetylglucosyl)(1->3)-galactoside

Isorhamnetin 3-(6-acetylglucosyl)(1->3)-galactoside

C30H34O18 (682.1745064)


   
   

Petunidin 3-glucoside-5-(6-acetylglucoside)

Petunidin 3-glucoside-5-(6-acetylglucoside)

C30H34O18 (682.1745064)


   

Delphinidin 3-(6-malonylsambubioside)

Delphinidin 3-(6-malonylsambubioside)

C29H30O19 (682.138123)


   

Haploside D

[3,4-Dihydroxy-6-[3,5,8-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]methyl acetate

C30H34O18 (682.1745064)


relative retention time with respect to 9-anthracene Carboxylic Acid is 0.974

   

Flavone base + 3O, 2MeO, O-HexA-HexA

Flavone base + 3O, 2MeO, O-HexA-HexA

C29H30O19 (682.138123)


Annotation level-3

   

[(2R,3S,4S,5R,6S)-3,4-dihydroxy-6-[3,7,8-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-5-yl]oxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methyl acetate_major

[(2R,3S,4S,5R,6S)-3,4-dihydroxy-6-[3,7,8-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-5-yl]oxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methyl acetate_major

C30H34O18 (682.1745064)


   

8-Hydroxyluteolin 4-methyl ether 7-(6-acetylallosyl-(1->2)-glucoside

8-Hydroxyluteolin 4-methyl ether 7-(6-acetylallosyl-(1->2)-glucoside

C30H34O18 (682.1745064)


   

Tricin 7-diglucuronoside

5-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-3,4-dihydroxy-6-{[5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxane-2-carboxylic acid

C29H30O19 (682.138123)


   

8-Hydroxyhesperetin 7-[6-acetylglucosyl-(1->2)-glucoside]

{6-[(2-{[5,8-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methyl acetate

C30H34O18 (682.1745064)


   

TAK-N

trimethyl({2-[4-(2-{4-[2-(trimethylazaniumyl)ethoxy]phenyl}pentyl)phenoxy]ethyl})azanium diiodide

C27H44I2N2O2 (682.1492144)


   

Gadoxetic acid

Gadoxetic acid

C23H30GdN3O11 (682.1121360000001)


V - Various > V08 - Contrast media > V08C - Magnetic resonance imaging contrast media > V08CA - Paramagnetic contrast media

   

4,4,4-tris(benzoyloxy)trityl bromide

4,4,4-tris(benzoyloxy)trityl bromide

C40H27BrO6 (682.0990902000001)


   

4,4,4,4-(1,3,6,8-Pyrenetetrayl)tetrabenzoic acid

4,4,4,4-(1,3,6,8-Pyrenetetrayl)tetrabenzoic acid

C44H26O8 (682.1627596000001)


   

Chlorobis[2-(diphenylphosphino)ethanamine]ruthenium(II) tetrafluoroborate

Chlorobis[2-(diphenylphosphino)ethanamine]ruthenium(II) tetrafluoroborate

C28H32BClF4N2P2Ru (682.0801720000001)


   
   

2-(Perfluorooctyl)ethyl dimorpholinophosphinate

2-(Perfluorooctyl)ethyl dimorpholinophosphinate

C18H20F17N2O4P (682.0889174)


   

AMMONIUM, ((PROPYLETHYLENE)BIS(p-PHENYLENEOXYETHYLENE))BIS(TRIMETHYL-, DIIODIDE

AMMONIUM, ((PROPYLETHYLENE)BIS(p-PHENYLENEOXYETHYLENE))BIS(TRIMETHYL-, DIIODIDE

C27H44I2N2O2 (682.1492144)


   

3-[18-(2-Carboxylatoethyl)-3,8,13,17-tetramethyl-7,12-bis(1-sulfanylethyl)porphyrin-21,23-diid-2-yl]propanoate;iron(2+)

3-[18-(2-Carboxylatoethyl)-3,8,13,17-tetramethyl-7,12-bis(1-sulfanylethyl)porphyrin-21,23-diid-2-yl]propanoate;iron(2+)

C34H34FeN4O4S2-2 (682.1370754000001)


   

(S)-Nadhx(1-)

(S)-Nadhx(1-)

C21H30N7O15P2- (682.127507)


The anion of (6S)-6-hydroxy-1,4,5,6-tetrahydronicotinamide adenine dinucleotide arising from deprotonation of both OH groups of the diphosphate moiety.

   

Ferroheme c(2-)

Ferroheme c(2-)

C34H34FeN4O4S2 (682.1370754000001)


The cyclic tetrapyrrole anion that is ferroheme c protonated to pH 7.3.

   

[(2r,3s,4r,5r,6s)-6-{[(2s,3r,4s,5s,6r)-2-{[5,8-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

[(2r,3s,4r,5r,6s)-6-{[(2s,3r,4s,5s,6r)-2-{[5,8-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

C30H34O18 (682.1745064)


   

[(2r,3s,4r,5r,6r)-6-{[(2r,3r,4s,5s,6r)-2-{[5,8-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

[(2r,3s,4r,5r,6r)-6-{[(2r,3r,4s,5s,6r)-2-{[5,8-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

C30H34O18 (682.1745064)


   

3-(acetyloxy)-5-{[2,4,7,8,9-pentakis(acetyloxy)oxanthren-1-yl]oxy}phenyl acetate

3-(acetyloxy)-5-{[2,4,7,8,9-pentakis(acetyloxy)oxanthren-1-yl]oxy}phenyl acetate

C32H26O17 (682.1169946)


   

2-[(6-{[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl)methoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl acetate

2-[(6-{[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl)methoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl acetate

C30H34O18 (682.1745064)


   

{6-[(2-{[5,8-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methyl acetate

{6-[(2-{[5,8-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methyl acetate

C30H34O18 (682.1745064)


   

{6-[(2-{[5,6-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methyl acetate

{6-[(2-{[5,6-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methyl acetate

C30H34O18 (682.1745064)


   

[(2r,3r,4s,5r,6s)-6-{[(2s,3r,4s,5r,6s)-2-{[5,8-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

[(2r,3r,4s,5r,6s)-6-{[(2s,3r,4s,5r,6s)-2-{[5,8-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

C30H34O18 (682.1745064)


   

(2s,3s,4s,5r,6s)-5-{[(2r,3r,4s,5s,6s)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy}-3,4-dihydroxy-6-{[5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxochromen-7-yl]oxy}oxane-2-carboxylic acid

(2s,3s,4s,5r,6s)-5-{[(2r,3r,4s,5s,6s)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy}-3,4-dihydroxy-6-{[5-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxochromen-7-yl]oxy}oxane-2-carboxylic acid

C29H30O19 (682.138123)


   

[(2e)-4-[(1r,4r,7s,8s)-3-[(5e)-5-[carboxy(4-hydroxyphenyl)methylidene]-4-hydroxy-2-oxofuran-3-yl]-8-hydroxy-5,9-dioxotricyclo[5.4.0.0⁴,⁸]undeca-2,10-dien-11-yl]-3-hydroxy-5-oxofuran-2-ylidene](4-hydroxyphenyl)acetic acid

[(2e)-4-[(1r,4r,7s,8s)-3-[(5e)-5-[carboxy(4-hydroxyphenyl)methylidene]-4-hydroxy-2-oxofuran-3-yl]-8-hydroxy-5,9-dioxotricyclo[5.4.0.0⁴,⁸]undeca-2,10-dien-11-yl]-3-hydroxy-5-oxofuran-2-ylidene](4-hydroxyphenyl)acetic acid

C35H22O15 (682.0958662)


   

[(2r,3s,4s,5r,6s)-3,4-dihydroxy-6-{[3,5,8-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy}-5-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]methyl acetate

[(2r,3s,4s,5r,6s)-3,4-dihydroxy-6-{[3,5,8-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy}-5-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]methyl acetate

C30H34O18 (682.1745064)


   

[(2r,3s,4s,5r,6s)-6-{[(2s,3r,4r,5s,6s)-2-{[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

[(2r,3s,4s,5r,6s)-6-{[(2s,3r,4r,5s,6s)-2-{[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

C30H34O18 (682.1745064)


   

(2r,3r,4s,5s,6r)-2-{[(2r,3s,4s,5r,6s)-6-{[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl acetate

(2r,3r,4s,5s,6r)-2-{[(2r,3s,4s,5r,6s)-6-{[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl acetate

C30H34O18 (682.1745064)


   

(3,4-dihydroxy-6-{[3,5,8-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy}-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl)methyl acetate

(3,4-dihydroxy-6-{[3,5,8-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy}-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl)methyl acetate

C30H34O18 (682.1745064)


   

{6-[(2-{[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methyl acetate

{6-[(2-{[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methyl acetate

C30H34O18 (682.1745064)


   

[4-(11-{5-[carboxy(4-hydroxyphenyl)methylidene]-4-hydroxy-2-oxofuran-3-yl}-8-hydroxy-5,9-dioxotricyclo[5.4.0.0⁴,⁸]undeca-2,10-dien-3-yl)-3-hydroxy-5-oxofuran-2-ylidene](4-hydroxyphenyl)acetic acid

[4-(11-{5-[carboxy(4-hydroxyphenyl)methylidene]-4-hydroxy-2-oxofuran-3-yl}-8-hydroxy-5,9-dioxotricyclo[5.4.0.0⁴,⁸]undeca-2,10-dien-3-yl)-3-hydroxy-5-oxofuran-2-ylidene](4-hydroxyphenyl)acetic acid

C35H22O15 (682.0958662)


   

[(2r,3s,4r,5r,6s)-6-{[(2s,3r,4s,5s,6r)-2-{[5,6-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

[(2r,3s,4r,5r,6s)-6-{[(2s,3r,4s,5s,6r)-2-{[5,6-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

C30H34O18 (682.1745064)


   

[(2r,3s,4s,5r,6s)-6-{[(2s,3r,4s,5s,6r)-2-{[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

[(2r,3s,4s,5r,6s)-6-{[(2s,3r,4s,5s,6r)-2-{[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

C30H34O18 (682.1745064)


   

[(2r,3s,4s,5r,6s)-6-{[(2s,3r,4s,5s,6r)-2-{[5,8-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

[(2r,3s,4s,5r,6s)-6-{[(2s,3r,4s,5s,6r)-2-{[5,8-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate

C30H34O18 (682.1745064)