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Ile-Lys-Cys

PropertiesImage
MNX_IDMNXM1121191 Image of MNXM1121191
referencechebi:158578
formulaC15H30N4O4S
global charge0
mol weight362.496
InChIKeyRFMDODRWJZHZCR-BJDJZHNGSA-N
InChIInChI=1S/C15H30N4O4S/c1-3-9(2)12(17)14(21)18-10(6-4-5-7-16)13(20)19-11(8-24)15(22)23/h9-12,24H,3-8,16-17H2,1-2H3,(H,18,21)(H,19,20)(H,22,23)/t9-,10-,11-,12-/m0/s1
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)O
MNX internals
InChI (mnx)InChI=1/C15H30N4O4S/c1-3-9(2)12(17)14(21)18-10(6-4-5-7-16)13(20)19-11(8-24)15(22)23/h9-12,24H,3-8,16-17H2,1-2H3,(H,18,21)(H,19,20)(H,22,23)/t9-,10-,11-,12-/m0/s1 Image of MNXM1121191
SMILES (mnx)[CH3:1][CH2:3][C@H:9]([CH3:2])[C@@H:12]([C:14](=[N:18][C@@H:10]([CH2:6][CH2:4][CH2:5][CH2:7][NH2:16])[C:13](=[N:19][C@@H:11]([CH2:8][SH:24])[C:15](=[O:22])[OH:23])[OH:20])[OH:21])[NH2:17]
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:158578
chebi:158578
RFMDODRWJZHZCR-BJDJZHNGSA-N
Ile-Lys-Cys
(2R)-2-[[(2S)-6-amino-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]hexanoyl]amino]-3-sulanylpropanoic acid