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(2S)-1-[(2S)-3-methyl-1-oxo-2-[[oxo-[(2S,3S)-3-[oxo(propylamino)methyl]-2-oxiranyl]methyl]amino]pentyl]-2-pyrrolidinecarboxylic acid methyl ester

PropertiesImage
MNX_IDMNXM170952 Image of MNXM170952
referencechebi:91767
formulaC19H31N3O6
global charge0
mol weight397.472
InChIKeyXGWSRLSPWIEMLQ-RQLZCWDZSA-N
InChIInChI=1S/C19H31N3O6/c1-5-9-20-16(23)14-15(28-14)17(24)21-13(11(3)6-2)18(25)22-10-7-8-12(22)19(26)27-4/h11-15H,5-10H2,1-4H3,(H,20,23)(H,21,24)/t11?,12-,13-,14-,15-/m0/s1
SMILESCCCNC(=O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)OC)C(C)CC
MNX internals
InChI (mnx)InChI=1/C19H31N3O6/c1-5-9-20-16(23)14-15(28-14)17(24)21-13(11(3)6-2)18(25)22-10-7-8-12(22)19(26)27-4/h11-15H,5-10H2,1-4H3,(H,20,23)(H,21,24)/t11?,12-,13-,14-,15-/m0/s1 Image of MNXM170952
SMILES (mnx)[CH3:1][CH2:5][CH2:9][N:20]=[C:16]([C@@H:14]1[C@@H:15]([C:17](=[N:21][C@@H:13]([CH:11]([CH3:3])[CH2:6][CH3:2])[C:18]([N:22]2[CH2:10][CH2:7][CH2:8][C@H:12]2[C:19](=[O:26])[O:27][CH3:4])=[O:25])[OH:24])[O:28]1)[OH:23]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:91767
chebi:91767
XGWSRLSPWIEMLQ-RQLZCWDZSA-N 		(2S)-1-[(2S)-3-methyl-1-oxo-2-[[oxo-[(2S,3S)-3-[oxo(propylamino)methyl]-2-oxiranyl]methyl]amino]pentyl]-2-pyrrolidinecarboxylic acid methyl ester
hmdb:HMDB0249521
XGWSRLSPWIEMLQ-UHFFFAOYSA-N 		Methyl N-({(2s,3s)-3-[(Propylamino)carbonyl]oxiran-2-Yl}carbonyl)-L-Isoleucyl-L-Prolinate
CA 074 methyl ester
CA-074me
CA074me
Methyl N-({(2S,3S)-3-[(propylamino)carbonyl]oxiran-2-yl}carbonyl)-L-isoleucyl-L-prolinic acid
N2-{1-[2-(methoxycarbonyl)pyrrolidin-1-yl]-3-methyl-1-oxopentan-2-yl}-N3-propyloxirane-2,3-dicarboximidate
methyl 1-(3-methyl-2-{[3-(propylcarbamoyl)oxiran-2-yl]formamido}pentanoyl)pyrrolidine-2-carboxylate