Ile-Cys (CHEBI:157862)

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-Cys

ChEBI ID	CHEBI:157862

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C9H18N2O3S

Net Charge

Average Mass

234.310

Monoisotopic Mass

234.10381

InChI

InChI=1S/C9H18N2O3S/c1-3-5(2)7(10)8(12)11-6(4-15)9(13)14/h5-7,15H,3-4,10H2,1-2H3,(H,11,12)(H,13,14)/t5-,6-,7-/m0/s1

InChIKey

JSZMKEYEVLDPDO-ACZMJKKPSA-N

SMILES

SC[C@H](NC(=O)[C@@H](N)[C@H](CC)C)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 )

ChEBI Ontology
Outgoing	Ile-Cys (CHEBI:157862) is a dipeptide (CHEBI:46761)

IUPAC Name

(2R)-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]-3-sulanylpropanoic acid

Registry Number	Type	Source
117525-90-3	CAS Registry Number	ChemIDplus