Search MNXref
 Feedback

Cys-Val-Ile

PropertiesImage
MNX_IDMNXM1124434 Image of MNXM1124434
referencechebi:161838
formulaC14H27N3O4S
global charge0
mol weight333.454
InChIKeyNGOIQDYZMIKCOK-NAKRPEOUSA-N
InChIInChI=1S/C14H27N3O4S/c1-5-8(4)11(14(20)21)17-13(19)10(7(2)3)16-12(18)9(15)6-22/h7-11,22H,5-6,15H2,1-4H3,(H,16,18)(H,17,19)(H,20,21)/t8-,9-,10-,11-/m0/s1
SMILESCC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CS)C(C)C)C(=O)O
MNX internals
InChI (mnx)InChI=1/C14H27N3O4S/c1-5-8(4)11(14(20)21)17-13(19)10(7(2)3)16-12(18)9(15)6-22/h7-11,22H,5-6,15H2,1-4H3,(H,16,18)(H,17,19)(H,20,21)/t8-,9-,10-,11-/m0/s1 Image of MNXM1124434
SMILES (mnx)[CH3:1][CH2:5][C@H:8]([CH3:4])[C@@H:11]([C:14](=[O:20])[OH:21])[N:17]=[C:13]([C@H:10]([CH:7]([CH3:2])[CH3:3])[N:16]=[C:12]([C@H:9]([CH2:6][SH:22])[NH2:15])[OH:18])[OH:19]
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:161838
chebi:161838
NGOIQDYZMIKCOK-NAKRPEOUSA-N
Cys-Val-Ile
(2S,3S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-3-methylbutanoyl]amino]-3-methylpentanoic acid