CHEBI:161050 - Met-Ser-Asn

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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-Asn
ChEBI ID CHEBI:161050
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H22N4O6S
Net Charge 0
Average Mass 350.390
Monoisotopic Mass 350.12601
InChI InChI=1S/C12H22N4O6S/c1-23-3-2-6(13)10(19)16-8(5-17)11(20)15-7(12(21)22)4-9(14)18/h6-8,17H,2-5,13H2,1H3,(H2,14,18)(H,15,20)(H,16,19)(H,21,22)/t6-,7-,8-/m0/s1
InChIKey PCTFVQATEGYHJU-FXQIFTODSA-N
SMILES S(CC[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N)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 )
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ChEBI Ontology
Outgoing Met-Ser-Asn (CHEBI:161050) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulanylbutanoyl]amino]-3-hydroxypropanoyl]amino]-4-oxobutanoic acid