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Ile-Gln-Cys

PropertiesImage
MNX_IDMNXM1120950 Image of MNXM1120950
referencechebi:158336
formulaC14H26N4O5S
global charge0
mol weight362.452
InChIKeyOONBGFHNQVSUBF-KBIXCLLPSA-N
InChIInChI=1S/C14H26N4O5S/c1-3-7(2)11(16)13(21)17-8(4-5-10(15)19)12(20)18-9(6-24)14(22)23/h7-9,11,24H,3-6,16H2,1-2H3,(H2,15,19)(H,17,21)(H,18,20)(H,22,23)/t7-,8-,9-,11-/m0/s1
SMILESCC[C@H](C)[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CS)C(=O)O
MNX internals
InChI (mnx)InChI=1/C14H26N4O5S/c1-3-7(2)11(16)13(21)17-8(4-5-10(15)19)12(20)18-9(6-24)14(22)23/h7-9,11,24H,3-6,16H2,1-2H3,(H2,15,19)(H,17,21)(H,18,20)(H,22,23)/t7-,8-,9-,11-/m0/s1 Image of MNXM1120950
SMILES (mnx)[CH3:1][CH2:3][C@H:7]([CH3:2])[C@@H:11]([C:13](=[N:17][C@@H:8]([CH2:4][CH2:5][C:10](=[NH:15])[OH:19])[C:12](=[N:18][C@@H:9]([CH2:6][SH:24])[C:14](=[O:22])[OH:23])[OH:20])[OH:21])[NH2:16]
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:158336
chebi:158336
OONBGFHNQVSUBF-KBIXCLLPSA-N
Ile-Gln-Cys
(2R)-2-[[(2S)-5-amino-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-5-oxopentanoyl]amino]-3-sulanylpropanoic acid