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daclatasvir

CHEBI:CHEBI_82977

Definition

A member of the class of biphenyls that is a potent inhibitor of nonstructural protein 5A and is used (as its hydrochloride salt) for treatment of hepatitis C.

Chemical Information

Molecular Formula
C40H50N8O6
Molecular Mass
738.87500
Charge
0
SMILES
COC(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1c1ncc([nH]1)-c1ccc(cc1)-c1ccc(cc1)-c1cnc([nH]1)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)OC)C(C)C
InChI
InChI=1S/C40H50N8O6/c1-23(2)33(45-39(51)53-5)37(49)47-19-7-9-31(47)35-41-21-29(43-35)27-15-11-25(12-16-27)26-13-17-28(18-14-26)30-22-42-36(44-30)32-10-8-20-48(32)38(50)34(24(3)4)46-40(52)54-6/h11-18,21-24,31-34H,7-10,19-20H2,1-6H3,(H,41,43)(H,42,44)(H,45,51)(H,46,52)/t31-,32-,33-,34-/m0/s1
InChIKey
FKRSSPOQAMALKA-CUPIEXAXSA-N

Alternative Names

  • BMS 790052
  • BMS-790052
  • BMS790052
  • Dimethyl N,N'-(biphenyl-4,4'-diylbis{1H-imidazole-5,2-diyl-((2S)-pyrrolidine-2,1- diyl)((1S)-1-(1-methylethyl)-2-oxoethane-2,1-diyl)})dicarbamate
  • methyl [(2S)-1-{(2S)-2-[4-(4'-{2-[(2S)-1-{(2S)-2-[(methoxycarbonyl)amino]-3-methylbutanoyl}pyrrolidin-2-yl]-1H-imidazol-4-yl}biphenyl-4-yl)-1H-imidazol-2-yl]pyrrolidin-1-yl}-3-methyl-1-oxobutan-2-yl]carbamate

Drug Classification

Important Medical Information

⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.

  • Always consult with a healthcare professional before starting, stopping, or modifying any medication.
  • Side effects may vary and this list may not be comprehensive.
  • Drug interactions may occur with other medications.

Additional Identifiers

DRON_00010000
1606218
oboInOwl#hasDbXref
Wikipedia:Daclatasvir
core#notation
CHEBI:82977

Additional References

Wikipedia:Daclatasvir

🔍 Click on any linked disease name to learn more about the conditions this medication is used to treat, or explore related drug classifications for more information about similar medications.

Additional Attributes

oboInOwl#hasOBONamespace
chebi_ontology
DRON_00010000
1606218
oboInOwl#hasDbXref
Wikipedia:Daclatasvir
oboInOwl#id
CHEBI:82977
core#notation
CHEBI:82977
listing_expiration_date
20241231
dosage_form
POWDER
marketing_start_date
20180329
product_type
BULK INGREDIENT
marketing_category
BULK INGREDIENT
active_ingredient_strength
1 kg/kg
labeler_name
MSN Life Sciences Private Limited
package_marketing_start_date
10-JAN-17
generic_name
Daclatasvir Dihydrochloride
product_ndc
68554-0094
spl_id
f338db49-8e53-a55e-e053-2995a90a055b
active_ingredient_name
DACLATASVIR DIHYDROCHLORIDE
package_ndc
68554-0094-1
package_description
15 kg in 1 DRUM (68554-0094-1)
RO_0000087
http://purl.obolibrary.org/obo/CHEBI_83799
oboInOwl#inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
chebi#is_conjugate_base_of
http://purl.obolibrary.org/obo/CHEBI_83801
22-rdf-syntax-ns#type
http://www.w3.org/2002/07/owl#Class
has_treatment
http://purl.obolibrary.org/obo/DOID_0060642
rdf-schema#domain
https://w3id.org/def/predibionto#has_side_effect36516
chebi#is_conjugate_acid_of
http://purl.obolibrary.org/obo/CHEBI_83801
owl#annotatedSource
t304151
owl#someValuesFrom
t2911368