CHEBI:159632 - Asn-Asp-Val

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ChEBI Name Asn-Asp-Val
ChEBI ID CHEBI:159632
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H22N4O7
Net Charge 0
Average Mass 346.340
Monoisotopic Mass 346.14885
InChI InChI=1S/C13H22N4O7/c1-5(2)10(13(23)24)17-12(22)7(4-9(19)20)16-11(21)6(14)3-8(15)18/h5-7,10H,3-4,14H2,1-2H3,(H2,15,18)(H,16,21)(H,17,22)(H,19,20)(H,23,24)/t6-,7-,10-/m0/s1
InChIKey IYVSIZAXNLOKFQ-BYULHYEWSA-N
SMILES O=C(N[C@@H](C(C)C)C(O)=O)[C@@H](NC(=O)[C@@H](N)CC(=O)N)CC(O)=O
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-Asp-Val (CHEBI:159632) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-3-carboxy-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]propanoyl]amino]-3-methylbutanoic acid