CHEBI:158651 - Ala-Val-Gln

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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 Ala-Val-Gln
ChEBI ID CHEBI:158651
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H24N4O5
Net Charge 0
Average Mass 316.358
Monoisotopic Mass 316.17467
InChI InChI=1S/C13H24N4O5/c1-6(2)10(17-11(19)7(3)14)12(20)16-8(13(21)22)4-5-9(15)18/h6-8,10H,4-5,14H2,1-3H3,(H2,15,18)(H,16,20)(H,17,19)(H,21,22)/t7-,8-,10-/m0/s1
InChIKey ZCUFMRIQCPNOHZ-NRPADANISA-N
SMILES O=C(N[C@@H](CCC(=O)N)C(O)=O)[C@@H](NC(=O)[C@@H](N)C)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 Ala-Val-Gln (CHEBI:158651) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-methylbutanoyl]amino]-5-oxopentanoic acid