velpatasvir
CHEBI:CHEBI_133009
Definition
A complex organic heteropentacyclic compound that is a hepatitis C virus nonstructural protein 5A inhibitor used in combination with sofosbuvir (under the brand name Epclusa) for treatment of patients with chronic hepatitis C of all six major genotypes.
Chemical Information
- Molecular Formula
- C49H54N8O8
- Molecular Mass
- 883.004
- Charge
- 0
- SMILES
- C(N1[C@@H](C)CC[C@H]1C2=NC=3C=CC=4C=C5C6=CC=C(C7=CN=C([C@@H]8C[C@H](COC)CN8C(=O)[C@@H](C=9C=CC=CC9)NC(=O)OC)N7)C=C6COC5=CC4C3N2)(=O)[C@H](C(C)C)NC(=O)OC
- InChI
- InChI=1S/C49H54N8O8/c1-26(2)41(54-48(60)63-5)47(59)57-27(3)12-17-38(57)45-51-36-16-14-30-20-35-33-15-13-31(19-32(33)25-65-40(35)21-34(30)43(36)53-45)37-22-50-44(52-37)39-18-28(24-62-4)23-56(39)46(58)42(55-49(61)64-6)29-10-8-7-9-11-29/h7-11,13-16,19-22,26-28,38-39,41-42H,12,17-18,23-25H2,1-6H3,(H,50,52)(H,51,53)(H,54,60)(H,55,61)/t27-,28-,38-,39-,41-,42+/m0/s1
- InChIKey
- FHCUMDQMBHQXKK-CDIODLITSA-N
Alternative Names
- GS 5816
- GS-5816
- GS5816
- velpatasvir
- methyl {(2S)-1-[(2S,5S)-2-(9-{2-[(2S,4S)-1-{(2R)-2-[(methoxycarbonyl)amino]-2-phenylacetyl}-4-(methoxymethyl)pyrrolidin-2-yl]-1H-imidazol-4-yl}-1,11-dihydro[2]benzopyrano[4',3':6,7]naphtho[1,2-d]imidazol-2-yl)-5-methylpyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl}carbamate
Treatment Applications
Drug Classification
-
etherView Class →
CHEBI:25698
-
carbamate esterView Class →
CHEBI:23003
-
imidazolesView Class →
CHEBI:24780
-
ring assemblyView Class →
CHEBI:36820
-
N-acylpyrrolidineView Class →
CHEBI:46766
-
L-valine derivativeView Class →
CHEBI:84129
-
organic heteropentacyclic compoundView Class →
CHEBI:38164
-
t100381
-
t100429
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
- 1799206
- oboInOwl#hasDbXref
- Wikipedia:Velpatasvir
- core#notation
- CHEBI:133009
Additional References
🔍 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
- 1799206
- oboInOwl#hasDbXref
- Wikipedia:Velpatasvir
- oboInOwl#id
- CHEBI:133009
- core#notation
- CHEBI:133009
- RO_0000087
- http://purl.obolibrary.org/obo/CHEBI_85185
- oboInOwl#inSubset
- http://purl.obolibrary.org/obo/chebi#3_STAR
- 22-rdf-syntax-ns#type
- http://www.w3.org/2002/07/owl#Class
- rdf-schema#range
- https://w3id.org/def/predibionto#has_drug_112636
- rdf-schema#domain
- https://w3id.org/def/predibionto#has_side_effect1936
- owl#annotatedSource
- t100735
- owl#someValuesFrom
- t3861937