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Ile-Ser-Val

PropertiesImage
MNX_IDMNXM1121378 Image of MNXM1121378
referencechebi:158766
formulaC14H27N3O5
global charge0
mol weight317.386
InChIKeyHXIDVIFHRYRXLZ-NAKRPEOUSA-N
InChIInChI=1S/C14H27N3O5/c1-5-8(4)10(15)13(20)16-9(6-18)12(19)17-11(7(2)3)14(21)22/h7-11,18H,5-6,15H2,1-4H3,(H,16,20)(H,17,19)(H,21,22)/t8-,9-,10-,11-/m0/s1
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C
MNX internals
InChI (mnx)InChI=1/C14H27N3O5/c1-5-8(4)10(15)13(20)16-9(6-18)12(19)17-11(7(2)3)14(21)22/h7-11,18H,5-6,15H2,1-4H3,(H,16,20)(H,17,19)(H,21,22)/t8-,9-,10-,11-/m0/s1 Image of MNXM1121378
SMILES (mnx)[CH3:1][CH2:5][C@H:8]([CH3:4])[C@@H:10]([C:13](=[N:16][C@@H:9]([CH2:6][OH:18])[C:12](=[N:17][C@@H:11]([CH:7]([CH3:2])[CH3:3])[C:14](=[O:21])[OH:22])[OH:19])[OH:20])[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:158766
chebi:158766
HXIDVIFHRYRXLZ-NAKRPEOUSA-N
Ile-Ser-Val
(2S)-2-[[(2S)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-3-methylbutanoic acid