CHEBI:161052 - Met-Ser-Asp

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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 Met-Ser-Asp
ChEBI ID CHEBI:161052
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H21N3O7S
Net Charge 0
Average Mass 351.370
Monoisotopic Mass 351.11002
InChI InChI=1S/C12H21N3O7S/c1-23-3-2-6(13)10(19)15-8(5-16)11(20)14-7(12(21)22)4-9(17)18/h6-8,16H,2-5,13H2,1H3,(H,14,20)(H,15,19)(H,17,18)(H,21,22)/t6-,7-,8-/m0/s1
InChIKey RDLSEGZJMYGFNS-FXQIFTODSA-N
SMILES S(CC[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CC(O)=O)C(O)=O)CO)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 Met-Ser-Asp (CHEBI:161052) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-hydroxypropanoyl]amino]butanedioic acid