CHEBI:166227 - Val-His-Pro

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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-His-Pro
ChEBI ID CHEBI:166227
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H25N5O4
Net Charge 0
Average Mass 351.407
Monoisotopic Mass 351.19065
InChI InChI=1S/C16H25N5O4/c1-9(2)13(17)14(22)20-11(6-10-7-18-8-19-10)15(23)21-5-3-4-12(21)16(24)25/h7-9,11-13H,3-6,17H2,1-2H3,(H,18,19)(H,20,22)(H,24,25)/t11-,12+,13-/m0/s1
InChIKey YTUABZMPYKCWCQ-XQQFMLRXSA-N
SMILES O=C(N1[C@H](CCC1)C(O)=O)[C@@H](NC(=O)[C@@H](N)C(C)C)CC=2NC=NC2
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-His-Pro (CHEBI:166227) is a peptide (CHEBI:16670)
IUPAC Name
(2R)-1-[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carboxylic acid