CHEBI:157820 - His-Met-Gly

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 His-Met-Gly
ChEBI ID CHEBI:157820
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H21N5O4S
Net Charge 0
Average Mass 343.400
Monoisotopic Mass 343.13143
InChI InChI=1S/C13H21N5O4S/c1-23-3-2-10(13(22)16-6-11(19)20)18-12(21)9(14)4-8-5-15-7-17-8/h5,7,9-10H,2-4,6,14H2,1H3,(H,15,17)(H,16,22)(H,18,21)(H,19,20)/t9-,10-/m0/s1
InChIKey YXASFUBDSDAXQD-UWVGGRQHSA-N
SMILES S(CC[C@H](NC(=O)[C@@H](N)CC=1NC=NC1)C(=O)NCC(O)=O)C
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 His-Met-Gly (CHEBI:157820) is a peptide (CHEBI:16670)
IUPAC Name
2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylsulanylbutanoyl]amino]acetic acid