CHEBI:40050 - amprenavir

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ChEBI Name amprenavir
ChEBI ID CHEBI:40050
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:40043, CHEBI:2684
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Formula C25H35N3O6S
Net Charge 0
Average Mass 505.62802
Monoisotopic Mass 505.22466
InChI InChI=1S/C25H35N3O6S/c1-18(2)15-28(35(31,32)22-10-8-20(26)9-11-22)16-24(29)23(14-19-6-4-3-5-7-19)27-25(30)34-21-12-13-33-17-21/h3-11,18,21,23-24,29H,12-17,26H2,1-2H3,(H,27,30)/t21-,23-,24+/m0/s1
InChIKey YMARZQAQMVYCKC-OEMFJLHTSA-N
SMILES CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CCOC1)S(=O)(=O)c1ccc(N)cc1
Roles Classification
Biological Role(s): HIV protease inhibitor
An inhibitor of HIV protease, an enzyme required for production of proteins needed for viral assembly.
antiviral drug
A substance used in the prophylaxis or therapy of virus diseases.
Application(s): antiviral drug
A substance used in the prophylaxis or therapy of virus diseases.
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ChEBI Ontology
Outgoing amprenavir (CHEBI:40050) has role antiviral drug (CHEBI:36044)
amprenavir (CHEBI:40050) has role HIV protease inhibitor (CHEBI:35660)
amprenavir (CHEBI:40050) is a carbamate ester (CHEBI:23003)
amprenavir (CHEBI:40050) is a sulfonamide (CHEBI:35358)
amprenavir (CHEBI:40050) is a tetrahydrofuryl ester (CHEBI:47020)
IUPAC Name
(3S)-tetrahydrofuran-3-yl [(1S,2R)-3-{[(4-aminophenyl)sulfonyl](2-methylpropyl)amino}-1-benzyl-2-hydroxypropyl]carbamate
Synonyms Sources
(3S)-Tetrahydro-3-furanyl ((1S,2R)-3-(((4-aminophenyl)sulfonyl)(2-methylpropyl)amino)-2-hydroxy-1-(phenylmethyl)propyl)carbamate ChemIDplus
Agenerase ChemIDplus
Amprenavir KEGG COMPOUND
Amprenavir KEGG DRUG
Manual Xrefs Databases
200 DrugCentral
Amprenavir Wikipedia
C08086 KEGG COMPOUND
D00894 KEGG DRUG
DB00701 DrugBank
View more database links
Registry Numbers Types Sources
10126027 Beilstein Registry Number Beilstein
161814-49-9 CAS Registry Number ChemIDplus
Last Modified
22 February 2017