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CHEBI:750004 - bq 788

Default Structure
ChEBI IDCHEBI:750004
ChEBI Namebq 788
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC34H51N5O7
Net Charge0
Average Mass641.810
Monoisotopic Mass641.37885
SMILESCCCC[C@@H](NC(=O)[C@@H](Cc1cn(C(=O)OC)c2ccccc12)NC(=O)[C@H](CC(C)(C)C)NC(=O)N1[C@H](C)CCC[C@@H]1C)C(=O)O
InChIInChI=1S/C34H51N5O7/c1-8-9-16-25(31(42)43)35-29(40)26(18-23-20-38(33(45)46-7)28-17-11-10-15-24(23)28)36-30(41)27(19-34(4,5)6)37-32(44)39-21(2)13-12-14-22(39)3/h10-11,15,17,20-22,25-27H,8-9,12-14,16,18-19H2,1-7H3,(H,35,40)(H,36,41)(H,37,44)(H,42,43)/t21-,22+,25-,26-,27+/m1/s1
InChIKeyLPAHKJMGDSJDRG-DJYQTOCQSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Application:
cardiovascular drug  A drug that affects the rate or intensity of cardiac contraction, blood vessel diameter or blood volume.
ChEBI Ontology
Outgoing Relation(s)
bq 788 (CHEBI:750004) has role cardiovascular drug (CHEBI:35554)
bq 788 (CHEBI:750004) is a polypeptide (CHEBI:15841)
Synonym  Source
Bq 788ChEMBL