Exact Mass: 514.1466
Exact Mass Matches: 514.1466
Found 81 metabolites which its exact mass value is equals to given mass value 514.1466,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
2',6'-Di-O-acetylononin
[5-(Acetyloxy)-3,4-dihydroxy-6-{[3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxan-2-yl]methyl acetic acid
2,6-Di-O-acetylononin is found in pulses. 2,6-Di-O-acetylononin is a constituent of soybeans, Glycine max.
2-[2-(4-Methylphenyl)ethylsulfanyl]-3-[4-[2-(4-methylsulfonyloxyphenoxy)ethyl]phenyl]propanoic acid
3-(4-{2-[4-(methanesulfonyloxy)phenoxy]ethyl}phenyl)-2-{[2-(4-methylphenyl)ethyl]sulfanyl}propanoic acid
4-O-(2-O-acetyl-6-O-p-coumaroyl-beta-D-glucopyranosyl)-p-coumaric acid
4-O-(2-O-acetyl-6-O-p-coumaroyl-beta-D-glucopyranosyl)-p-coumaric acid
(5xi,6S)-4,5-Di-O-acetyl-2,6-anhydro-1-deoxy-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl]-6-methyl-D-arabino-hexitol
(5xi,6S)-4,5-Di-O-acetyl-2,6-anhydro-1-deoxy-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yl]-6-methyl-D-arabino-hexitol
Cys Asp Asp Tyr
(3S)-3-[(2R)-2-amino-3-sulfanylpropanamido]-3-{[(1S)-2-carboxy-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}ethyl]carbamoyl}propanoic acid
Cys Asp Phe Met
(3S)-3-[(2R)-2-amino-3-sulfanylpropanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}-2-phenylethyl]carbamoyl}propanoic acid
Cys Asp Met Phe
(3S)-3-[(2R)-2-amino-3-sulfanylpropanamido]-3-{[(1S)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid
Cys Asp Tyr Asp
(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carboxypropanamido]-3-(4-hydroxyphenyl)propanamido]butanedioic acid
Cys Phe Asp Met
(3S)-3-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanamido]-3-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid
Cys Phe Met Asp
(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanamido]-4-(methylsulfanyl)butanamido]butanedioic acid
Cys Met Asp Phe
(3S)-3-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-3-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}propanoic acid
Cys Met Phe Asp
(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-3-phenylpropanamido]butanedioic acid
Cys Met Met Met
(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-4-(methylsulfanyl)butanamido]-4-(methylsulfanyl)butanoic acid
Cys Tyr Asp Asp
(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-carboxypropanamido]butanedioic acid
Asp Cys Asp Tyr
(3S)-3-[(2R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-sulfanylpropanamido]-3-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid
Asp Cys Phe Met
(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-sulfanylpropanamido]-3-phenylpropanamido]-4-(methylsulfanyl)butanoic acid
Asp Cys Met Phe
(3S)-3-amino-3-{[(1R)-1-{[(1S)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}-2-sulfanylethyl]carbamoyl}propanoic acid
Asp Cys Tyr Asp
(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]butanedioic acid
Asp Asp Cys Tyr
(3S)-3-[(2S)-2-amino-3-carboxypropanamido]-3-{[(1R)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}propanoic acid
Asp Asp Tyr Cys
(3S)-3-[(2S)-2-amino-3-carboxypropanamido]-3-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}propanoic acid
Asp Phe Cys Met
(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-phenylpropanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanoic acid
Asp Phe Met Cys
(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}-2-phenylethyl]carbamoyl}propanoic acid
Asp Met Cys Phe
(3S)-3-amino-3-{[(1S)-1-{[(1R)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid
Asp Met Phe Cys
(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-phenylethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid
Asp Tyr Cys Asp
(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]butanedioic acid
Asp Tyr Asp Cys
(3S)-3-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid
Phe Cys Asp Met
(3S)-3-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanamido]-3-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid
Phe Cys Met Asp
(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]butanedioic acid
Phe Asp Cys Met
(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-carboxypropanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanoic acid
Phe Asp Met Cys
(3S)-3-[(2S)-2-amino-3-phenylpropanamido]-3-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}propanoic acid
Phe Met Cys Asp
(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]butanedioic acid
Phe Met Asp Cys
(3S)-3-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-4-(methylsulfanyl)butanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid
Met Cys Asp Phe
(3S)-3-[(2R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-3-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}propanoic acid
Met Cys Phe Asp
(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-3-phenylpropanamido]butanedioic acid
Met Cys Met Met
(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanamido]-4-(methylsulfanyl)butanoic acid
Met Asp Cys Phe
(3S)-3-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-{[(1R)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-2-sulfanylethyl]carbamoyl}propanoic acid
Met Asp Phe Cys
(3S)-3-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-{[(1S)-1-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}-2-phenylethyl]carbamoyl}propanoic acid
Met Phe Cys Asp
(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-phenylpropanamido]-3-sulfanylpropanamido]butanedioic acid
Met Phe Asp Cys
(3S)-3-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-phenylpropanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid
Met Met Cys Met
(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-(methylsulfanyl)butanamido]-3-sulfanylpropanamido]-4-(methylsulfanyl)butanoic acid
Met Met Met Cys
(2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-(methylsulfanyl)butanamido]-4-(methylsulfanyl)butanamido]-3-sulfanylpropanoic acid
Tyr Cys Asp Asp
(2S)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]-3-carboxypropanamido]butanedioic acid
Tyr Asp Cys Asp
(2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-carboxypropanamido]-3-sulfanylpropanamido]butanedioic acid
Tyr Asp Asp Cys
(3S)-3-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-carboxypropanamido]-3-{[(1R)-1-carboxy-2-sulfanylethyl]carbamoyl}propanoic acid
2'',6''-Di-O-acetylononin
[5-(acetyloxy)-3,4-dihydroxy-6-{[3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxan-2-yl]methyl acetate
2-[3-(ethylamino)-6-ethylimino-2,7-dimethylxanthen-9-yl]benzoic acid
2-[3-(ethylamino)-6-ethylimino-2,7-dimethylxanthen-9-yl]benzoic acid
Methyl 4-(3-{[(3-Methoxy-5-Methylpyrazin-2-yl)[(2-Methylpropoxy)carbonyl]amino]sulfonyl}pyridin-2-yl)benzoate
Methyl 4-(3-{[(3-Methoxy-5-Methylpyrazin-2-yl)[(2-Methylpropoxy)carbonyl]amino]sulfonyl}pyridin-2-yl)benzoate
[9-(2-carboxyphenyl)-6-(diethylamino)-2,7-dimethylxanthen-3-ylidene]-diethylazanium,perchlorate
[9-(2-carboxyphenyl)-6-(diethylamino)-2,7-dimethylxanthen-3-ylidene]-diethylazanium,perchlorate
R-3,3-bis(4-chlorophenyl)-5,5,6,6,7,7,8,8-octahydro-[1,1-Binaphthalene]-2,2-diol
R-3,3-bis(4-chlorophenyl)-5,5,6,6,7,7,8,8-octahydro-[1,1-Binaphthalene]-2,2-diol
2',6'-Di-O-acetylononin
[5-(Acetyloxy)-3,4-dihydroxy-6-{[3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxan-2-yl]methyl acetic acid
2,6-Di-O-acetylononin is found in pulses. 2,6-Di-O-acetylononin is a constituent of soybeans, Glycine max. Constituent of soybeans, Glycine max. Formononetin 7-(2,6-diacetylglucoside) is found in pulses.
Cys-Met-Met-Met
Cys-Met-Met-Met
A tetrapeptide composed of one L-cysteine and three L-methionine units joined by peptide linkages.
6-[[1,9-dihydroxy-2-(3-methylbut-2-enyl)-6H-[1]benzouro[3,2-c]chromen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
6-[[1,9-dihydroxy-2-(3-methylbut-2-enyl)-6H-[1]benzouro[3,2-c]chromen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
3-(4-{[3-(acetyloxy)-4,5-dihydroxy-6-({[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid
3-(4-{[3-(acetyloxy)-4,5-dihydroxy-6-({[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid
2'',6''-o-diacetyloninin
NA
{"Ingredient_id": "HBIN004989","Ingredient_name": "2'',6''-o-diacetyloninin","Alias": "NA","Ingredient_formula": "C26H26O11","Ingredient_Smile": "CC(=O)OCC1C(C(C(C(O1)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=C(C=C4)OC)OC(=O)C)O)O","Ingredient_weight": "514.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5342","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "10207893","DrugBank_id": "NA"}
5-{[5-(2-amino-2-carboxyethyl)-1-methylimidazol-4-yl]sulfanyl}-6,8-dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
5-{[5-(2-amino-2-carboxyethyl)-1-methylimidazol-4-yl]sulfanyl}-6,8-dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
3-acetyl-4-{[(3-acetyl-7-hydroxy-5-methoxy-3-methyl-1-oxo-2-benzofuran-4-yl)methoxy]methyl}-7-hydroxy-5-methoxy-3-methyl-2-benzofuran-1-one
3-acetyl-4-{[(3-acetyl-7-hydroxy-5-methoxy-3-methyl-1-oxo-2-benzofuran-4-yl)methoxy]methyl}-7-hydroxy-5-methoxy-3-methyl-2-benzofuran-1-one
3,4-dihydroxy-1-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}-5-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}cyclohexane-1-carboxylic acid
3,4-dihydroxy-1-{[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}-5-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}cyclohexane-1-carboxylic acid
{11-acetyl-7-[(3-acetyl-2,6-dihydroxy-5-methylphenyl)methyl]-3,10-dihydroxy-13-methyl-6-oxo-2,5-dioxatricyclo[7.4.0.0³,⁷]trideca-1(13),9,11-trien-4-yl}acetic acid
{11-acetyl-7-[(3-acetyl-2,6-dihydroxy-5-methylphenyl)methyl]-3,10-dihydroxy-13-methyl-6-oxo-2,5-dioxatricyclo[7.4.0.0³,⁷]trideca-1(13),9,11-trien-4-yl}acetic acid
[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-{[3-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}oxan-2-yl]methyl (2e)-but-2-enoate
[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-{[3-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}oxan-2-yl]methyl (2e)-but-2-enoate
(2s,4s)-4-{[(2r,3r,4r,5r,6s)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy}-2,5,7-trihydroxy-2-methyl-3,4-dihydrotetracene-1,6,11-trione
(2s,4s)-4-{[(2r,3r,4r,5r,6s)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy}-2,5,7-trihydroxy-2-methyl-3,4-dihydrotetracene-1,6,11-trione
(3s,10as)-3-chloro-10a-{[(1s,3s,6s)-3-chloro-6-hydroxy-2,2,6-trimethylcyclohexyl]methyl}-4a,6,8-trihydroxy-2,2-dimethyl-3h,4h-naphtho[2,3-b]pyran-5,10-dione
(3s,10as)-3-chloro-10a-{[(1s,3s,6s)-3-chloro-6-hydroxy-2,2,6-trimethylcyclohexyl]methyl}-4a,6,8-trihydroxy-2,2-dimethyl-3h,4h-naphtho[2,3-b]pyran-5,10-dione
(2e)-3-(4-{[(2s,3r,4s,5s,6r)-3-(acetyloxy)-4,5-dihydroxy-6-({[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid
(2e)-3-(4-{[(2s,3r,4s,5s,6r)-3-(acetyloxy)-4,5-dihydroxy-6-({[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid
(1r,3r)-5-({5-[(2s)-2-amino-2-carboxyethyl]-1-methylimidazol-4-yl}sulfanyl)-6,8-dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
(1r,3r)-5-({5-[(2s)-2-amino-2-carboxyethyl]-1-methylimidazol-4-yl}sulfanyl)-6,8-dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-{[3-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}oxan-2-yl]methyl but-2-enoate
[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-{[3-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}oxan-2-yl]methyl but-2-enoate
(1s,3s)-5-({5-[(2s)-2-amino-2-carboxyethyl]-1-methylimidazol-4-yl}sulfanyl)-6,8-dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
(1s,3s)-5-({5-[(2s)-2-amino-2-carboxyethyl]-1-methylimidazol-4-yl}sulfanyl)-6,8-dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
(1r,3r,4s,5s)-3,4-dihydroxy-1-{[(2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}-5-{[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}cyclohexane-1-carboxylic acid
(1r,3r,4s,5s)-3,4-dihydroxy-1-{[(2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}-5-{[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}cyclohexane-1-carboxylic acid
(3r)-3-acetyl-4-({[(3r)-3-acetyl-7-hydroxy-5-methoxy-3-methyl-1-oxo-2-benzofuran-4-yl]methoxy}methyl)-7-hydroxy-5-methoxy-3-methyl-2-benzofuran-1-one
(3r)-3-acetyl-4-({[(3r)-3-acetyl-7-hydroxy-5-methoxy-3-methyl-1-oxo-2-benzofuran-4-yl]methoxy}methyl)-7-hydroxy-5-methoxy-3-methyl-2-benzofuran-1-one
(1s,3s)-5-{[5-(2-amino-2-carboxyethyl)-1-methylimidazol-4-yl]sulfanyl}-6,8-dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
(1s,3s)-5-{[5-(2-amino-2-carboxyethyl)-1-methylimidazol-4-yl]sulfanyl}-6,8-dihydroxy-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
[(3s,4s,7r)-11-acetyl-7-[(3-acetyl-2,6-dihydroxy-5-methylphenyl)methyl]-3,10-dihydroxy-13-methyl-6-oxo-2,5-dioxatricyclo[7.4.0.0³,⁷]trideca-1(13),9,11-trien-4-yl]acetic acid
[(3s,4s,7r)-11-acetyl-7-[(3-acetyl-2,6-dihydroxy-5-methylphenyl)methyl]-3,10-dihydroxy-13-methyl-6-oxo-2,5-dioxatricyclo[7.4.0.0³,⁷]trideca-1(13),9,11-trien-4-yl]acetic acid
4-[(4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl)oxy]-2,5,7-trihydroxy-2-methyl-3,4-dihydrotetracene-1,6,11-trione
4-[(4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl)oxy]-2,5,7-trihydroxy-2-methyl-3,4-dihydrotetracene-1,6,11-trione
