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Asp-Gln-Ile

PropertiesImage
MNX_IDMNXM1123093 Image of MNXM1123093
referencechebi:160493
formulaC15H26N4O7
global charge0
mol weight374.394
InChIKeyPMEHKVHZQKJACS-PEFMBERDSA-N
InChIInChI=1S/C15H26N4O7/c1-3-7(2)12(15(25)26)19-14(24)9(4-5-10(17)20)18-13(23)8(16)6-11(21)22/h7-9,12H,3-6,16H2,1-2H3,(H2,17,20)(H,18,23)(H,19,24)(H,21,22)(H,25,26)/t7-,8-,9-,12-/m0/s1
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(=O)O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C15H26N4O7/c1-3-7(2)12(15(25)26)19-14(24)9(4-5-10(17)20)18-13(23)8(16)6-11(21)22/h7-9,12H,3-6,16H2,1-2H3,(H2,17,20)(H,18,23)(H,19,24)(H,21,22)(H,25,26)/t7-,8-,9-,12-/m0/s1 Image of MNXM1123093
SMILES (mnx)[CH3:1][CH2:3][C@H:7]([CH3:2])[C@@H:12]([C:15](=[O:25])[OH:26])[N:19]=[C:14]([C@H:9]([CH2:4][CH2:5][C:10](=[NH:17])[OH:20])[N:18]=[C:13]([C@H:8]([CH2:6][C:11](=[O:21])[OH:22])[NH2:16])[OH:23])[OH:24]
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:160493
chebi:160493
PMEHKVHZQKJACS-PEFMBERDSA-N
Asp-Gln-Ile
(2S,3S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]-5-oxopentanoyl]amino]-3-methylpentanoic acid