CHEBI:73014 - Ac-Gln-D-Phe-His-D-Pro-βAla-βAla

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ChEBI Name Ac-Gln-D-Phe-His-D-Pro-βAla-βAla ChEBI ID CHEBI:73014 ChEBI ASCII Name Ac-Gln-D-Phe-His-D-Pro-betaAla-betaAla Definition An oligopeptide comprising N2-acetyl-L-glutamine, D-phenylalanine, L-histidine, D-proline and two β-alanine residues coupled in sequence. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C33H45N9O9 Net Charge 0 Average Mass 711.76530 Monoisotopic Mass 711.33402 InChI InChI=1S/C33H45N9O9/c1-20(43)39-23(9-10-27(34)44)30(48)40-24(16-21-6-3-2-4-7-21)31(49)41-25(17-22-18-35-19-38-22)33(51)42-15-5-8-26(42)32(50)37-13-11-28(45)36-14-12-29(46)47/h2-4,6-7,18-19,23-26H,5,8-17H2,1H3,(H2,34,44)(H,35,38)(H,36,45)(H,37,50)(H,39,43)(H,40,48)(H,41,49)(H,46,47)/t23-,24+,25-,26+/m0/s1 InChIKey SMPKUSOIDAPUBS-ROXDYWFKSA-N SMILES CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NCCC(O)=O 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 Ac-Gln-D-Phe-His-D-Pro-βAla-βAla (CHEBI:73014) is a oligopeptide (CHEBI:25676) IUPAC Name N2-acetyl-L-glutaminyl-D-phenylalanyl-L-histidyl-D-prolyl-β-alanyl-β-alanine Synonyms Sources Ac-QfHpββ-OH ChEBI N-ACETYL-L-GLN-D-PHE-L-HIS-D-PRO-B-ALA-B-ALA-OH PDB Manual Xrefs Databases 1MCF PDB 1MCH PDB View more database links Citation Type Source 8346191 PubMed citation Europe PMC Last Modified 26 March 2013