CHEBI:165034 - Tyr-Gln-Asn

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-Gln-Asn
ChEBI ID CHEBI:165034
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H25N5O7
Net Charge 0
Average Mass 423.426
Monoisotopic Mass 423.17540
InChI InChI=1S/C18H25N5O7/c19-11(7-9-1-3-10(24)4-2-9)16(27)22-12(5-6-14(20)25)17(28)23-13(18(29)30)8-15(21)26/h1-4,11-13,24H,5-8,19H2,(H2,20,25)(H2,21,26)(H,22,27)(H,23,28)(H,29,30)/t11-,12-,13-/m0/s1
InChIKey CRHFOYCJGVJPLE-AVGNSLFASA-N
SMILES O=C(N[C@@H](CC(=O)N)C(O)=O)[C@@H](NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)CCC(=O)N
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-Gln-Asn (CHEBI:165034) is a peptide (CHEBI:16670)
IUPAC Name
(2S)-4-amino-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxopentanoyl]amino]-4-oxobutanoic acid