CHEBI:160267 - Asn-Val-Ser

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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 Asn-Val-Ser
ChEBI ID CHEBI:160267
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H22N4O6
Net Charge 0
Average Mass 318.330
Monoisotopic Mass 318.15393
InChI InChI=1S/C12H22N4O6/c1-5(2)9(11(20)15-7(4-17)12(21)22)16-10(19)6(13)3-8(14)18/h5-7,9,17H,3-4,13H2,1-2H3,(H2,14,18)(H,15,20)(H,16,19)(H,21,22)/t6-,7-,9-/m0/s1
InChIKey PQKSVQSMTHPRIB-ZKWXMUAHSA-N
SMILES O=C(N[C@@H](CO)C(O)=O)[C@@H](NC(=O)[C@@H](N)CC(=O)N)C(C)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 Asn-Val-Ser (CHEBI:160267) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-3-methylbutanoyl]amino]-3-hydroxypropanoic acid