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Laninamivir

CAT: 1410-M13162-03Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M13162-03Size:1 mL x 10 mM in DMSO
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Laninamivir (CS-8958) is a prodrug of the influenza neuraminidase (NA) inhibitor R-125489.
CAS Number
203120-46-1
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
472.539
Molecular Formula
C21H36N4O8
Notes
Research use only, not for human use.
Receptor
Influenza Virus

Chemical Information

Laninamivir octanoate

Laninamivir octanoate hydrate is a fatty acid ester.

CAS Number203120-46-1
PubChem CID9847629
IUPAC Name(2R,3R,4S)-3-acetamido-4-(diaminomethylideneamino)-2-[(1R,2R)-2-hydroxy-1-methoxy-3-octanoyloxypropyl]-3,4-dihydro-2H-pyran-6-carboxylic acid
Molecular FormulaC21H36N4O8
Molecular Weight472.5
XLogP0.4
Topological Polar Surface Area196
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count9
Rotatable Bond Count15
Heavy Atom Count33
Formal Charge0
Complexity723
SMILES
CCCCCCCC(=O)OC[C@H]([C@H]([C@H]1[C@@H]([C@H](C=C(O1)C(=O)O)N=C(N)N)NC(=O)C)OC)O
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
Chemical Structure
2D Structure
2D structure of Laninamivir octanoate
CAS: 203120-46-1
CID: 9847629
Formula: C21H36N4O8
MW: 472.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight472.5
XLogP30.4
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count9
Rotatable Bond Count15
Exact Mass472.25331412
Monoisotopic Mass472.25331412
Topological Polar Surface Area196 Ų
Heavy Atom Count33
Formal Charge0
Complexity723
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BA2010-25Laninamivir

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