CHEBI:134741 - laninamivir octanoate hydrate

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ChEBI Name laninamivir octanoate hydrate
ChEBI ID CHEBI:134741
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H36N4O8
Net Charge 0
Average Mass 472.533
Monoisotopic Mass 472.25331
InChI InChI=1S/C21H36N4O8/c1-4-5-6-7-8-9-16(28)32-11-14(27)18(31-3)19-17(24-12(2)26)13(25-21(22)23)10-15(33-19)20(29)30/h10,13-14,17-19,27H,4-9,11H2,1-3H3,(H,24,26)(H,29,30)(H4,22,23,25)/t13-,14+,17+,18+,19+/m0/s1
InChIKey UKTIJASCFRNWCB-RMIBSVFLSA-N
SMILES [C@H]([C@@H](COC(CCCCCCC)=O)O)(OC)[C@]1([C@H](NC(C)=O)[C@@H](NC(=N)N)C=C(C(O)=O)O1)[H]
ChEBI Ontology
Outgoing laninamivir octanoate hydrate (CHEBI:134741) is a fatty acid ester (CHEBI:35748)
Synonyms Sources
CS-8958 DrugCentral
inavir DrugCentral
laninamivir octanoate DrugCentral
Manual Xref Database
4822 DrugCentral
View more database links
Registry Number Type Source
203120-46-1 CAS Registry Number DrugCentral
Last Modified
23 February 2017