Taxagifine structure

Taxagifine

(3,4,6,11-tetraacetyloxy-2-hydroxy-1,5,15-trimethyl-9-methylidene-14-oxo-16-oxatetracyclo[10.5.0.02,15.05,10]heptadecan-8-yl) 3-phenylprop-2-enoate

Also Known As: Taxagifine

CAS: 81489-69-2
Molecular Formula C37H44O13
Molecular Weight 696.2782 g/mol
LogP 3.0497
Topological Polar Surface Area 178.03 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 13
Rotatable Bonds 7
Exact Mass 696.2782
Monoisotopic Mass 696.2782
Heavy Atoms 50
Complexity 1634.202

Chemical Identifiers

CAS Number 81489-69-2
SMILES CC(=O)OC1CC(C(=C)C2C1(C(C(C3(C4(COC3(C(=O)CC4C2OC(=O)C)C)C)O)OC(=O)C)OC(=O)C)C)OC(=O)C=CC5=CC=CC=C5

Product Overview

Taxagifine (CAS 81489-69-2), with molecular formula C37H44O13 and molecular weight 696.2782 g/mol. IUPAC: (3,4,6,11-tetraacetyloxy-2-hydroxy-1,5,15-trimethyl-9-methylidene-14-oxo-16-oxatetracyclo[10.5.0.02,15.05,10]heptadecan-8-yl) 3-phenylprop-2-enoate.

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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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