CHEBI:166303 - Val-Met-His

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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-Met-His
ChEBI ID CHEBI:166303
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H27N5O4S
Net Charge 0
Average Mass 385.480
Monoisotopic Mass 385.17838
InChI InChI=1S/C16H27N5O4S/c1-9(2)13(17)15(23)20-11(4-5-26-3)14(22)21-12(16(24)25)6-10-7-18-8-19-10/h7-9,11-13H,4-6,17H2,1-3H3,(H,18,19)(H,20,23)(H,21,22)(H,24,25)/t11-,12-,13-/m0/s1
InChIKey SBJCTAZFSZXWSR-AVGNSLFASA-N
SMILES S(CC[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](CC=1NC=NC1)C(O)=O)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-Met-His (CHEBI:166303) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-4-methylsulanylbutanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid