Uvaricin structure

Uvaricin

[(1S)-1-[(2R,5R)-5-[(2R)-5-[(1R)-1-hydroxy-13-[(2S)-2-methyl-5-oxo-2H-furan-4-yl]tridecyl]oxolan-2-yl]oxolan-2-yl]undecyl] acetate

Also Known As: Uvaricin|[(1S)-1-[(2R,5R)-5-[(2R)-5-[(1R)-1-hydroxy-13-[(2S)-2-methyl-5-oxo-2H-furan-4-yl]tridecyl]oxolan-2-yl]oxolan-2-yl]undecyl] acetate|2(5H)-Furanone, 3-(13-(5'-(1-(acetyloxy)undecyl)octahydro(2,2'-bifuran)-5-yl)-13-hydroxytridecyl)-5-methyl-

CAS: 82064-83-3
Molecular Formula C39H68O7
Molecular Weight 648.4965 g/mol
LogP 11.8
Topological Polar Surface Area 91.3 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 27
Exact Mass 648.4965
Monoisotopic Mass 648.4965
Heavy Atoms 46
Complexity 872.0

Chemical Identifiers

CAS Number 82064-83-3
SMILES CCCCCCCCCC[C@@H]([C@H]1CC[C@@H](O1)[C@H]2CCC(O2)[C@@H](CCCCCCCCCCCCC3=C[C@@H](OC3=O)C)O)OC(=O)C
InChIKey JQOYPOSGHDJFLI-SZANTZNSSA-N

Product Overview

Uvaricin (CAS 82064-83-3), with molecular formula C39H68O7 and molecular weight 648.4965 g/mol. IUPAC: [(1S)-1-[(2R,5R)-5-[(2R)-5-[(1R)-1-hydroxy-13-[(2S)-2-methyl-5-oxo-2H-furan-4-yl]tridecyl]oxolan-2-yl]oxolan-2-yl]undecyl] acetate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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