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CHEBI:756604 - beclabuvir

Default Structure
ChEBI IDCHEBI:756604
ChEBI Namebeclabuvir
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC36H45N5O5S
Net Charge0
Average Mass659.853
Monoisotopic Mass659.31414
SMILES[H][C@]12CC[C@]([H])(CN(C)C1)N2C(=O)[C@@]12Cn3c(c(C4CCCCC4)c4ccc(C(=O)NS(=O)(=O)N(C)C)cc43)-c3ccc(OC)cc3[C@]1([H])C2
InChIInChI=1S/C36H45N5O5S/c1-38(2)47(44,45)37-34(42)23-10-14-28-31(16-23)40-21-36(35(43)41-24-11-12-25(41)20-39(3)19-24)18-30(36)29-17-26(46-4)13-15-27(29)33(40)32(28)22-8-6-5-7-9-22/h10,13-17,22,24-25,30H,5-9,11-12,18-21H2,1-4H3,(H,37,42)/t24-,25+,30-,36-/m0/s1
InChIKeyZTTKEBYSXUCBSE-QDFUAKMASA-N
Roles Classification
Biological Role:
antiviral agent  A substance that destroys or inhibits replication of viruses.
ChEBI Ontology
Outgoing Relation(s)
beclabuvir (CHEBI:756604) has role antiviral agent (CHEBI:22587)
beclabuvir (CHEBI:756604) is a indolecarboxamide (CHEBI:46921)
INN  Source
beclabuvirWHO MedNet
Synonym  Source
BMS-791325ChEMBL
Citations