CHEBI:166175 - Val-Glu-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 Val-Glu-Asn
ChEBI ID CHEBI:166175
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H24N4O7
Net Charge 0
Average Mass 360.367
Monoisotopic Mass 360.16450
InChI InChI=1S/C14H24N4O7/c1-6(2)11(16)13(23)17-7(3-4-10(20)21)12(22)18-8(14(24)25)5-9(15)19/h6-8,11H,3-5,16H2,1-2H3,(H2,15,19)(H,17,23)(H,18,22)(H,20,21)(H,24,25)/t7-,8-,11-/m0/s1
InChIKey CVIXTAITYJQMPE-LAEOZQHASA-N
SMILES O=C(N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(=O)N)C(O)=O)[C@@H](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 Val-Glu-Asn (CHEBI:166175) is a peptide (CHEBI:16670)
IUPAC Name
(4S)-5-[[(1S)-3-amino-1-carboxy-3-oxopropyl]amino]-4-[[(2S)-2-amino-3-methylbutanoyl]amino]-5-oxopentanoic acid