CHEBI:145924 - Kaletra

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ChEBI Name Kaletra
ChEBI ID CHEBI:145924
Definition A mixture containing lopinavir and ritonavir. It is a prescription medicine that is used with other antiretroviral medicines to treat Human Immunodeficiency Virus-1 (HIV-1) infection in adults and children 14 days of age and older.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C37H48N6O5S2.C37H48N4O5
Net Charge 0
Average Mass 1349.760
Monoisotopic Mass 1348.67523
InChI InChI=1S/C37H48N6O5S2.C37H48N4O5/c1-24(2)33(42-36(46)43(5)20-29-22-49-35(40-29)25(3)4)34(45)39-28(16-26-12-8-6-9-13-26)18-32(44)31(17-27-14-10-7-11-15-27)41-37(47)48-21-30-19-38-23-50-30;1-25(2)34(41-20-12-19-38-37(41)45)36(44)39-30(21-28-15-7-5-8-16-28)23-32(42)31(22-29-17-9-6-10-18-29)40-33(43)24-46-35-26(3)13-11-14-27(35)4/h6-15,19,22-25,28,31-33,44H,16-18,20-21H2,1-5H3,(H,39,45)(H,41,47)(H,42,46);5-11,13-18,25,30-32,34,42H,12,19-24H2,1-4H3,(H,38,45)(H,39,44)(H,40,43)/t28-,31-,32-,33-;30-,31-,32-,34-/m00/s1
InChIKey OFFWOVJBSQMVPI-RMLGOCCBSA-N
SMILES C1=CC=CC(C[C@@H](C[C@@H]([C@@H](NC(=O)COC=2C(=CC=CC2C)C)CC3=CC=CC=C3)O)NC(=O)[C@H](C(C)C)N4CCCNC4=O)=C1.[C@H](CC1=CC=CC=C1)(C[C@@H]([C@H](CC2=CC=CC=C2)NC(OCC3=CN=CS3)=O)O)NC([C@@H](NC(N(CC=4N=C(C(C)C)SC4)C)=O)C(C)C)=O
Roles Classification
Biological Role(s): anticoronaviral agent
Any antiviral agent which inhibits the activity of coronaviruses.
antiviral drug
A substance used in the prophylaxis or therapy of virus diseases.
HIV protease inhibitor
An inhibitor of HIV protease, an enzyme required for production of proteins needed for viral assembly.
Application(s): antiviral drug
A substance used in the prophylaxis or therapy of virus diseases.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Kaletra (CHEBI:145924) has part lopinavir (CHEBI:31781)
Kaletra (CHEBI:145924) has part ritonavir (CHEBI:45409)
Kaletra (CHEBI:145924) has role anticoronaviral agent (CHEBI:149553)
Kaletra (CHEBI:145924) has role antiviral drug (CHEBI:36044)
Kaletra (CHEBI:145924) has role HIV protease inhibitor (CHEBI:35660)
Kaletra (CHEBI:145924) is a mixture (CHEBI:60004)
Synonyms Sources
ABT-378 & ABT-538 ChEBI
lopinavir & ritonavir ChEBI
lopinavir and ritonavir KEGG DRUG
lopinavir mixture with ritonavir ChEBI
lopinavir-ritonavir ChEBI
lopinavir-ritonavir mixt ChemIDplus
lopinavir/ritonavir ChemIDplus
ritonavir and lopinavir mixture ChemIDplus
ritonavir-boosted lopinavir ChEBI
Brand Names Sources
Aluvia ChemIDplus
Kaletra ChemIDplus
Lopimune ChEBI
Manual Xrefs Databases
D02498 KEGG DRUG
Lopinavir/ritonavir Wikipedia
View more database links
Registry Number Type Source
369372-47-4 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
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Last Modified
23 April 2020