CHEBI:158336 - Ile-Gln-Cys

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Ile-Gln-Cys
ChEBI ID CHEBI:158336
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H26N4O5S
Net Charge 0
Average Mass 362.450
Monoisotopic Mass 362.16239
InChI InChI=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
InChIKey OONBGFHNQVSUBF-KBIXCLLPSA-N
SMILES SC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)[C@H](CC)C)CCC(=O)N)C(O)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Ile-Gln-Cys (CHEBI:158336) is a oligopeptide (CHEBI:25676)
IUPAC Name
(2R)-2-[[(2S)-5-amino-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-5-oxopentanoyl]amino]-3-sulanylpropanoic acid