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Cys-Glu-Ile

PropertiesImage
MNX_IDMNXM1123917 Image of MNXM1123917
referencechebi:161319
formulaC14H25N3O6S
global charge0
mol weight363.436
InChIKeyCFQVGYWKSLKWFX-KBIXCLLPSA-N
InChIInChI=1S/C14H25N3O6S/c1-3-7(2)11(14(22)23)17-13(21)9(4-5-10(18)19)16-12(20)8(15)6-24/h7-9,11,24H,3-6,15H2,1-2H3,(H,16,20)(H,17,21)(H,18,19)(H,22,23)/t7-,8-,9-,11-/m0/s1
SMILESCC[C@H](C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CS)C(=O)O
MNX internals
InChI (mnx)InChI=1/C14H25N3O6S/c1-3-7(2)11(14(22)23)17-13(21)9(4-5-10(18)19)16-12(20)8(15)6-24/h7-9,11,24H,3-6,15H2,1-2H3,(H,16,20)(H,17,21)(H,18,19)(H,22,23)/t7-,8-,9-,11-/m0/s1 Image of MNXM1123917
SMILES (mnx)[CH3:1][CH2:3][C@H:7]([CH3:2])[C@@H:11]([C:14](=[O:22])[OH:23])[N:17]=[C:13]([C@H:9]([CH2:4][CH2:5][C:10](=[O:18])[OH:19])[N:16]=[C:12]([C@H:8]([CH2:6][SH:24])[NH2:15])[OH:20])[OH:21]
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:161319
chebi:161319
CFQVGYWKSLKWFX-KBIXCLLPSA-N
Cys-Glu-Ile
(2S,3S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-4-carboxybutanoyl]amino]-3-methylpentanoic acid