Exact Mass: 561.1893246000001
Exact Mass Matches: 561.1893246000001
Found 247 metabolites which its exact mass value is equals to given mass value 561.1893246000001
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
N-Dealkylated derivative
N-[(2S)-1-[[(E,3S)-1-(Benzenesulfonyl)-5-phenylpent-1-en-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]morpholine-4-carboxamide
5,9-Diepimer, N-Me,O3-de-Me,O3-beta-D-glucopyranoside-beta-Lumicolchicine
(-)-rel-(2R,3S,4R,5R,10S,2S)-1-[2,3,4,5-tetrahydro-5,10-dihydroxy-2-(4-methoxyphenyl)-6,8-dimethoxy-3-phenyl-2,5-methano-1-benzoxepin-4-carbonyl]-2-methoxypyrrolidine|ponapensin
(7bS)-7c-(Acetyl-methyl-amino)-2-beta-D-glucopyranosyloxy-1,3,9-trimethoxy-(7br,10ac)-6,7,7b,10a-tetrahydro-5H-benzo[a]cyclopenta[3,4]cyclbuta[1,2-c]cyclohepten-8-on|(7bS)-7c-(acetyl-methyl-amino)-2-beta-D-glucopyranosyloxy-1,3,9-trimethoxy-(7br,10ac)-6,7,7b,10a-tetrahydro-5H-benzo[a]cyclopenta[3,4]cyclobuta[1,2-c]cyclohepten-8-one
His Tyr Gln Asp
Cys Asn Tyr Tyr
C25H31N5O8S (561.1893246000001)
Cys Tyr Asn Tyr
C25H31N5O8S (561.1893246000001)
Cys Tyr Tyr Asn
C25H31N5O8S (561.1893246000001)
Asp His Gln Tyr
Asp His Tyr Gln
Asp Asn Gln Trp
Asp Asn Trp Gln
Asp Gln His Tyr
Asp Gln Asn Trp
Asp Gln Trp Asn
Asp Gln Tyr His
Asp Trp Asn Gln
Asp Trp Gln Asn
Asp Tyr His Gln
Asp Tyr Gln His
Glu His Asn Tyr
Glu His Tyr Asn
Glu Met Pro Trp
Glu Met Trp Pro
Glu Asn His Tyr
Glu Asn Asn Trp
Glu Asn Trp Asn
Glu Asn Tyr His
Glu Pro Met Trp
Glu Pro Trp Met
Glu Trp Met Pro
Glu Trp Asn Asn
Glu Trp Pro Met
Glu Tyr His Asn
Glu Tyr Asn His
Phe His Met Gln
C25H35N7O6S (561.2369410000001)
Phe His Gln Met
C25H35N7O6S (561.2369410000001)
Phe Met His Gln
C25H35N7O6S (561.2369410000001)
Phe Met Gln His
C25H35N7O6S (561.2369410000001)
Phe Gln His Met
C25H35N7O6S (561.2369410000001)
Phe Gln Met His
C25H35N7O6S (561.2369410000001)
Gly His Trp Tyr
Gly His Tyr Trp
Gly Asn Trp Trp
Gly Trp His Tyr
Gly Trp Asn Trp
Gly Trp Trp Asn
Gly Trp Tyr His
Gly Tyr His Trp
Gly Tyr Trp His
His Asp Gln Tyr
His Asp Tyr Gln
His Glu Asn Tyr
His Glu Tyr Asn
His Phe Met Gln
C25H35N7O6S (561.2369410000001)
His Phe Gln Met
C25H35N7O6S (561.2369410000001)
His Gly Trp Tyr
His Gly Tyr Trp
His Met Phe Gln
C25H35N7O6S (561.2369410000001)
His Met Gln Phe
C25H35N7O6S (561.2369410000001)
His Asn Glu Tyr
His Asn Tyr Glu
His Gln Asp Tyr
His Gln Phe Met
C25H35N7O6S (561.2369410000001)
His Gln Met Phe
C25H35N7O6S (561.2369410000001)
His Gln Tyr Asp
His Trp Gly Tyr
His Trp Tyr Gly
His Tyr Asp Gln
His Tyr Glu Asn
His Tyr Gly Trp
His Tyr Asn Glu
His Tyr Trp Gly
Met Glu Pro Trp
Met Glu Trp Pro
Met Phe His Gln
C25H35N7O6S (561.2369410000001)
Met Phe Gln His
C25H35N7O6S (561.2369410000001)
Met His Phe Gln
C25H35N7O6S (561.2369410000001)
Met His Gln Phe
C25H35N7O6S (561.2369410000001)
Met Pro Glu Trp
Met Pro Trp Glu
Met Gln Phe His
C25H35N7O6S (561.2369410000001)
Met Gln His Phe
C25H35N7O6S (561.2369410000001)
Met Trp Glu Pro
Met Trp Pro Glu
Asn Cys Tyr Tyr
C25H31N5O8S (561.1893246000001)
Asn Asp Gln Trp
Asn Asp Trp Gln
Asn Glu His Tyr
Asn Glu Asn Trp
Asn Glu Trp Asn
Asn Glu Tyr His
Asn Gly Trp Trp
Asn His Glu Tyr
Asn His Tyr Glu
Asn Asn Glu Trp
Asn Asn Trp Glu
Asn Gln Asp Trp
Asn Gln Trp Asp
Asn Trp Asp Gln
Asn Trp Glu Asn
Asn Trp Gly Trp
Asn Trp Asn Glu
Asn Trp Gln Asp
Asn Trp Trp Gly
Asn Tyr Cys Tyr
C25H31N5O8S (561.1893246000001)
Asn Tyr Glu His
Asn Tyr His Glu
Asn Tyr Tyr Cys
C25H31N5O8S (561.1893246000001)
Pro Glu Met Trp
Pro Glu Trp Met
Pro Met Glu Trp
Pro Met Trp Glu
Pro Trp Glu Met
Pro Trp Met Glu
Gln Asp His Tyr
Gln Asp Asn Trp
Gln Asp Trp Asn
Gln Asp Tyr His
Gln Phe His Met
C25H35N7O6S (561.2369410000001)
Gln Phe Met His
C25H35N7O6S (561.2369410000001)
Gln His Asp Tyr
Gln His Phe Met
C25H35N7O6S (561.2369410000001)
Gln His Met Phe
C25H35N7O6S (561.2369410000001)
Gln His Tyr Asp
Gln Met Phe His
C25H35N7O6S (561.2369410000001)
Gln Met His Phe
C25H35N7O6S (561.2369410000001)
Gln Asn Asp Trp
Gln Asn Trp Asp
Gln Trp Asp Asn
Gln Trp Asn Asp
Gln Tyr Asp His
Gln Tyr His Asp
Trp Asp Asn Gln
Trp Asp Gln Asn
Trp Glu Met Pro
Trp Glu Asn Asn
Trp Glu Pro Met
Trp Gly His Tyr
Trp Gly Asn Trp
Trp Gly Trp Asn
Trp Gly Tyr His
Trp His Gly Tyr
Trp His Tyr Gly
Trp Met Glu Pro
Trp Met Pro Glu
Trp Asn Asp Gln
Trp Asn Glu Asn
Trp Asn Gly Trp
Trp Asn Asn Glu
Trp Asn Gln Asp
Trp Asn Trp Gly
Trp Pro Glu Met
Trp Pro Met Glu
Trp Gln Asp Asn
Trp Gln Asn Asp
Trp Trp Gly Asn
Trp Trp Asn Gly
Trp Tyr Gly His
Trp Tyr His Gly
Tyr Cys Asn Tyr
C25H31N5O8S (561.1893246000001)
Tyr Cys Tyr Asn
C25H31N5O8S (561.1893246000001)
Tyr Asp His Gln
Tyr Asp Gln His
Tyr Glu His Asn
Tyr Glu Asn His
Tyr Gly His Trp
Tyr Gly Trp His
Tyr His Asp Gln
Tyr His Glu Asn
Tyr His Gly Trp
Tyr His Asn Glu
Tyr His Gln Asp
Tyr His Trp Gly
Tyr Asn Cys Tyr
C25H31N5O8S (561.1893246000001)
Tyr Asn Glu His
Tyr Asn His Glu
Tyr Asn Tyr Cys
C25H31N5O8S (561.1893246000001)
Tyr Gln Asp His
Tyr Gln His Asp
Tyr Trp Gly His
Tyr Trp His Gly
Tyr Tyr Cys Asn
C25H31N5O8S (561.1893246000001)
Tyr Tyr Asn Cys
C25H31N5O8S (561.1893246000001)
ethyl 2-[1-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]-2-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)pyrrolidin-3-yl]-1,3-thiazole-4-carboxylate
(2S,3R,4S,5R)-6-Chloro-4-(3-chloro-2-fluorophenyl)-2-(2,2-dimethylpropyl)-N-(trans-4-hydroxycyclohexyl)-2-oxo-1,2-dihydrospiro(indole-3,3-pyrrolidine)-5-carboxamide
C274 - Antineoplastic Agent > C129839 - Apoptotic Pathway-targeting Antineoplastic Agent > C162996 - MDM2 Inhibitor
N-(4-{[4-(diethylamino)phenyl](5-hydroxy-2,4-disulfophenyl)methylene}cyclohexa-2,5-dien-1-ylidene)-N-ethylethanaminium
C27H33N2O7S2+ (561.1729088000001)
N-[(2S)-1-[[(E,3S)-1-(Benzenesulfonyl)-5-phenylpent-1-en-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]morpholine-4-carboxamide
N-[(4R,7R,8S)-5-(1,3-benzodioxole-5-carbonyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide
C27H35N3O8S (561.2144750000001)
N-[(4S,7R,8R)-5-[1,3-benzodioxol-5-yl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide
C27H35N3O8S (561.2144750000001)
N-[(4S,7S,8S)-5-(1,3-benzodioxole-5-carbonyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide
C27H35N3O8S (561.2144750000001)
2-[(2S,4aR,12aS)-8-[(2-fluorophenyl)carbamoylamino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(2-pyridin-4-ylethyl)acetamide
2-[(2S,4aS,12aS)-8-[[(2-fluoroanilino)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(2-pyridin-4-ylethyl)acetamide
2-[(2R,4aR,12aS)-8-[(2-fluorophenyl)carbamoylamino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(2-pyridin-4-ylethyl)acetamide
N-[(4R,7S,8S)-5-(1,3-benzodioxole-5-carbonyl)-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide
C27H35N3O8S (561.2144750000001)
2-[(2S,4aS,12aR)-8-[[(2-fluoroanilino)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(2-pyridin-4-ylethyl)acetamide
2-[(2R,4aS,12aR)-8-[(2-fluorophenyl)carbamoylamino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(2-pyridin-4-ylethyl)acetamide
2-[(2R,4aR,12aR)-8-[(2-fluorophenyl)carbamoylamino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(2-pyridin-4-ylethyl)acetamide
N-[(4R,7S,8R)-5-[1,3-benzodioxol-5-yl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide
C27H35N3O8S (561.2144750000001)
N-[(4S,7S,8R)-5-[1,3-benzodioxol-5-yl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide
C27H35N3O8S (561.2144750000001)
N-[(4S,7S,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(3,3,3-trifluoropropyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methyl-4-imidazolesulfonamide
C24H34F3N5O5S (561.2232630000001)
N-[(4R,7S,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(3,3,3-trifluoropropyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methyl-4-imidazolesulfonamide
C24H34F3N5O5S (561.2232630000001)
N-[(4R,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(3,3,3-trifluoropropyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methyl-4-imidazolesulfonamide
C24H34F3N5O5S (561.2232630000001)
2-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-6-[[(4-methoxyanilino)-oxomethyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide
2-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-6-[[(4-methoxyanilino)-oxomethyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide
2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-[[(4-methoxyanilino)-oxomethyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide
N-[(4S,7R,8S)-5-[1,3-benzodioxol-5-yl(oxo)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]ethanesulfonamide
C27H35N3O8S (561.2144750000001)
N-[(4S,7S,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(3,3,3-trifluoropropyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methyl-4-imidazolesulfonamide
C24H34F3N5O5S (561.2232630000001)
N-[(4R,7S,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(3,3,3-trifluoropropyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methyl-4-imidazolesulfonamide
C24H34F3N5O5S (561.2232630000001)
N-[(4S,7R,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(3,3,3-trifluoropropyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methyl-4-imidazolesulfonamide
C24H34F3N5O5S (561.2232630000001)
N-[(4R,7R,8S)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(3,3,3-trifluoropropyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methyl-4-imidazolesulfonamide
C24H34F3N5O5S (561.2232630000001)
N-[(4S,7R,8R)-8-methoxy-4,7,10-trimethyl-11-oxo-5-(3,3,3-trifluoropropyl)-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-1-methyl-4-imidazolesulfonamide
C24H34F3N5O5S (561.2232630000001)
2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[[(4-methoxyanilino)-oxomethyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide
2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-[[(4-methoxyanilino)-oxomethyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide
2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-[[(4-methoxyanilino)-oxomethyl]amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-(1,3-benzodioxol-5-ylmethyl)acetamide
2-[(2S,4aR,12aR)-8-[[(2-fluoroanilino)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(2-pyridin-4-ylethyl)acetamide
2-[(2R,4aS,12aS)-8-[[(2-fluoroanilino)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(2-pyridin-4-ylethyl)acetamide
2-[(2R,4aS,12aS)-5-methyl-6-oxo-8-(2,2,2-trifluoroethylsulfonylamino)-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(cyclohexylmethyl)acetamide
C25H34F3N3O6S (561.2120300000001)
alpha-D-Kdo-4P-(2->6)-beta-D-GlcNAc-OAll
An amino disaccharide consisting of a 3-deoxy-4-O-phosphono-D-manno-oct-2-ulose residue attached to beta-glucosamine via an alpha-(2->6)-linkage with an O-allyl group at the anomeric centre.
alpha-D-Kdo-5P-(2->6)-beta-D-GlcNAc-OAll
An amino disaccharide consisting of a 3-deoxy-5-O-phosphono-D-manno-oct-2-ulose residue attached to beta-glucosamine via an alpha-(2->6)-linkage with an O-allyl group at the anomeric centre.
alpha-L-Fucp-(1->3)-[beta-D-Galp4Cl-(1->4)]-beta-D-GlcpNAc-OMe
C21H36ClNO14 (561.1824226000001)
2-amino-4-({1-[(carboxymethyl)-C-hydroxycarbonimidoyl]-2-{[2-hydroxy-3-(4-methoxyphenyl)-3-oxo-1-phenylpropyl]sulfanyl}ethyl}-C-hydroxycarbonimidoyl)butanoic acid
2-aminoethyl beta-D-glucopyranosyl-(1->3)-beta-D-glucopyranuronosyl-(1->4)-beta-D-glucopyranoside
C20H35NO17 (561.1904900000001)
2-amino-4-({1-[(carboxymethyl)-C-hydroxycarbonimidoyl]-2-{[1-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-1,3-dihydroxypropan-2-yl]sulfanyl}ethyl}-C-hydroxycarbonimidoyl)butanoic acid
Aerobactinate(3-)
A tricarboxylate arising from deprotonation of the three carboxylic acid groups of aerobactin; major species at pH 7.3.
Arg-Gly-Glu-Ser (TFA)
Arg-Gly-Glu-Ser TFA is a RGD-related peptide and a control for the RGDS ihibitory activity on fibrinogen binding to activated platelets.
MI-773
MI-773 is a potent MDM2-p53 protein‐protein interaction (PPI) inhibitor with high binding affinity against MDM2 (Kd=8.2 nM). MI-773 has antitumor activity[1][2].