CHEBI:163874 - Gly-Met-Asp

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 Gly-Met-Asp
ChEBI ID CHEBI:163874
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H19N3O6S
Net Charge 0
Average Mass 321.350
Monoisotopic Mass 321.09946
InChI InChI=1S/C11H19N3O6S/c1-21-3-2-6(13-8(15)5-12)10(18)14-7(11(19)20)4-9(16)17/h6-7H,2-5,12H2,1H3,(H,13,15)(H,14,18)(H,16,17)(H,19,20)/t6-,7-/m0/s1
InChIKey OJNZVYSGVYLQIN-BQBZGAKWSA-N
SMILES S(CC[C@H](NC(=O)CN)C(=O)N[C@@H](CC(O)=O)C(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 Gly-Met-Asp (CHEBI:163874) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-2-[(2-aminoacetyl)amino]-4-methylsulanylbutanoyl]amino]butanedioic acid