CHEBI:162503 - Pro-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 Pro-Met-Asp
ChEBI ID CHEBI:162503
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H23N3O6S
Net Charge 0
Average Mass 361.410
Monoisotopic Mass 361.13076
InChI InChI=1S/C14H23N3O6S/c1-24-6-4-9(16-12(20)8-3-2-5-15-8)13(21)17-10(14(22)23)7-11(18)19/h8-10,15H,2-7H2,1H3,(H,16,20)(H,17,21)(H,18,19)(H,22,23)/t8-,9-,10-/m0/s1
InChIKey NTXFLJULRHQMDC-GUBZILKMSA-N
SMILES S(CC[C@H](NC(=O)[C@H]1NCCC1)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 Pro-Met-Asp (CHEBI:162503) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-4-methylsulanyl-2-[[(2S)-pyrrolidine-2-carbonyl]amino]butanoyl]amino]butanedioic acid