Chaparrinone triacetate,15-dehydro- structure

Chaparrinone triacetate,15-dehydro-

(3,15-diacetyloxy-2,6,14-trimethyl-4,11,16-trioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-5,12-dien-17-yl)methyl acetate

Also Known As: CHAPARRINONE TRIACETATE,15-DEHYDRO-|.DELTA.14,15-Chaparrinone triacetate|2,11,16-Trioxopicrasa-3,14-diene-1,12,20-triyl triacetate

CAS: 79752-54-8
Molecular Formula C26H30O10
Molecular Weight 502.1839 g/mol
LogP 0.9
Topological Polar Surface Area 139.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 10
Rotatable Bonds 7
Exact Mass 502.1839
Monoisotopic Mass 502.1839
Heavy Atoms 36
Complexity 1130.0

Chemical Identifiers

CAS Number 79752-54-8
SMILES CC1C(C(=O)C2C3(C(CC4C2(C1=CC(=O)O4)COC(=O)C)C(=CC(=O)C3OC(=O)C)C)C)OC(=O)C
InChIKey VYQXUJXNZSWNRT-UHFFFAOYSA-N

Product Overview

Chaparrinone triacetate,15-dehydro- (CAS 79752-54-8), with molecular formula C26H30O10 and molecular weight 502.1839 g/mol. IUPAC: (3,15-diacetyloxy-2,6,14-trimethyl-4,11,16-trioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-5,12-dien-17-yl)methyl 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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