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Structure

1-Deoxyforskolin

CAS
72963-77-0
Catalog Number
ACM72963770
Category
Other Products
Molecular Weight
394.5
Molecular Formula
C22H34O6

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Specification

Synonyms
1-Deoxyforskolin from Coleus forskohlii, SureCN4922859, D1290_SIGMA, 7|A-Acetoxy-6|A,9|A-dihydroxy-8,13-epoxy-labd-14-en-11-one, 7beta-Acetoxy-6beta,9alpha-dihydroxy-8,13-epoxy-labd-14-en-11-one, 72963-77-0
IUPAC Name
[(3R,4aR,5S,6S,6aS,10aS,10bS)-3-ethenyl-6,10b-dihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl] acetate
Canonical SMILES
CC(=O)OC1C(C2C(CCCC2(C3(C1(OC(CC3=O)(C)C=C)C)O)C)(C)C)O
InChI Key
PXYAFNGUEZPJBI-OAUGPMCWSA-N
Boiling Point
483.971ºC at 760mmHg
Melting Point
282ºC
Flash Point
157.989ºC
Density
1.183 g/cm³
Exact Mass
394.23600
H-Bond Acceptor
6
H-Bond Donor
2
WGK Germany
3
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