CHEBI:165119 - Tyr-Ile-His

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 Tyr-Ile-His
ChEBI ID CHEBI:165119
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H29N5O5
Net Charge 0
Average Mass 431.493
Monoisotopic Mass 431.21687
InChI InChI=1S/C21H29N5O5/c1-3-12(2)18(20(29)25-17(21(30)31)9-14-10-23-11-24-14)26-19(28)16(22)8-13-4-6-15(27)7-5-13/h4-7,10-12,16-18,27H,3,8-9,22H2,1-2H3,(H,23,24)(H,25,29)(H,26,28)(H,30,31)/t12-,16-,17-,18-/m0/s1
InChIKey DZKFGCNKEVMXFA-JUKXBJQTSA-N
SMILES O=C(N[C@@H](CC=1NC=NC1)C(O)=O)[C@@H](NC(=O)[C@@H](N)CC2=CC=C(O)C=C2)[C@H](CC)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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Tyr-Ile-His (CHEBI:165119) is a oligopeptide (CHEBI:25676)
IUPAC Name
(2S)-2-[[(2S,3S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylpentanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid