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Ile-Ser-Asn

PropertiesImage
MNX_IDMNXM1121344 Image of MNXM1121344
referencechebi:158732
formulaC13H24N4O6
global charge0
mol weight332.357
InChIKeyJODPUDMBQBIWCK-GHCJXIJMSA-N
InChIInChI=1S/C13H24N4O6/c1-3-6(2)10(15)12(21)17-8(5-18)11(20)16-7(13(22)23)4-9(14)19/h6-8,10,18H,3-5,15H2,1-2H3,(H2,14,19)(H,16,20)(H,17,21)(H,22,23)/t6-,7-,8-,10-/m0/s1
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C13H24N4O6/c1-3-6(2)10(15)12(21)17-8(5-18)11(20)16-7(13(22)23)4-9(14)19/h6-8,10,18H,3-5,15H2,1-2H3,(H2,14,19)(H,16,20)(H,17,21)(H,22,23)/t6-,7-,8-,10-/m0/s1 Image of MNXM1121344
SMILES (mnx)[CH3:1][CH2:3][C@H:6]([CH3:2])[C@@H:10]([C:12](=[N:17][C@@H:8]([CH2:5][OH:18])[C:11](=[N:16][C@@H:7]([CH2:4][C:9](=[NH:14])[OH:19])[C:13](=[O:22])[OH:23])[OH:20])[OH:21])[NH2:15]
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:158732
chebi:158732
JODPUDMBQBIWCK-GHCJXIJMSA-N
Ile-Ser-Asn
(2S)-4-amino-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-4-oxobutanoic acid