CHEBI:161552 - Cys-Met-Glu

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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 Cys-Met-Glu
ChEBI ID CHEBI:161552
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H23N3O6S2
Net Charge 0
Average Mass 381.460
Monoisotopic Mass 381.10283
InChI InChI=1S/C13H23N3O6S2/c1-24-5-4-8(15-11(19)7(14)6-23)12(20)16-9(13(21)22)2-3-10(17)18/h7-9,23H,2-6,14H2,1H3,(H,15,19)(H,16,20)(H,17,18)(H,21,22)/t7-,8-,9-/m0/s1
InChIKey POSRGGKLRWCUBE-CIUDSAMLSA-N
SMILES S(CC[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCC(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 )
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ChEBI Ontology
Outgoing Cys-Met-Glu (CHEBI:161552) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-4-methylsulanylbutanoyl]amino]pentanedioic acid