Isoforskolin [M+H]+ structure

Isoforskolin [M+H]+

(3-ethenyl-5,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-6-yl) acetate

Also Known As: Isoforskolin|Coleonol B|Coleforsin|Excolabdone C|Isoforskolin [M+H]+|6-Acetyl-7-deacetylforskolin|4CN-1908|Isoforskolin (constituent of forskohlii) [DSC]|6beta-acetoxy-8,13-epoxy-1alpha,7beta,9alpha-trihydroxylabd-14-en-11-one|(3-ethenyl-5,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-6-yl) acetate|1H-Naphtho(2,1-b)pyran-1-one, 6-(acetyloxy)-3-ethenyldodecahydro-5,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-, (3R-(3alpha,4abeta,5beta,6beta,6aalpha,10alpha,10abeta,10balpha))-|3-ethenyl-5,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-dodecahydro-1H-naphtho[2,1-b]pyran-6-yl acetate|6-Acetoxy-3-ethenyldodecahydro-5,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1H-naphtho[2,1-b]pyran-1-one

CAS: 64657-21-2
Molecular Formula C22H34O7
Molecular Weight 410.23044 g/mol
LogP 1.5199
Topological Polar Surface Area 113.29 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 7
Rotatable Bonds 2
Exact Mass 410.23044
Monoisotopic Mass 410.23044
Heavy Atoms 29
Complexity 747.4428

Chemical Identifiers

CAS Number 64657-21-2
SMILES CC(=O)OC1C2C(CCC(C2(C3(C(=O)CC(OC3(C1O)C)(C)C=C)O)C)O)(C)C

Product Overview

Isoforskolin [M+H]+ (CAS 64657-21-2), with molecular formula C22H34O7 and molecular weight 410.23044 g/mol. IUPAC: (3-ethenyl-5,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-6-yl) 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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