CHEBI:164397 - His-Gln-Cys

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ChEBI Name His-Gln-Cys
ChEBI ID CHEBI:164397
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C14H22N6O5S
Net Charge 0
Average Mass 386.430
Monoisotopic Mass 386.13724
InChI InChI=1S/C14H22N6O5S/c15-8(3-7-4-17-6-18-7)12(22)19-9(1-2-11(16)21)13(23)20-10(5-26)14(24)25/h4,6,8-10,26H,1-3,5,15H2,(H2,16,21)(H,17,18)(H,19,22)(H,20,23)(H,24,25)/t8-,9-,10-/m0/s1
InChIKey NJZGEXYLSFGPHG-GUBZILKMSA-N
SMILES SC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC=1NC=NC1)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 )
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ChEBI Ontology
Outgoing His-Gln-Cys (CHEBI:164397) is a peptide (CHEBI:16670)
IUPAC Name
(2R)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-5-oxopentanoyl]amino]-3-sulanylpropanoic acid