Dicirenone

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Catalog Number
ACM41020795
Product Name
Dicirenone
Structure
Structure
CAS
41020-79-5
Category
Heterocyclic Organic Compound
Synonyms
Dicirenone;SC 26304;(17R)-17-Hydroxy-3-oxo-7α-(isopropyloxycarbonyl)pregn-4-ene-21-carboxylic acid γ-lactone
IUPAC Name
propan-2-yl (7R,8R,9S,10R,13S,14S,17R)-10,13-dimethyl-3,5-dioxospiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17,2-oxolane]-7-carboxylate
Molecular Weight
428.565
Molecular Formula
C26H36O5
Canonical SMILES
CC(C)OC(=O)C1CC2=CC(=O)CCC2(C3C1C4CCC5(C4(CC3)C)CCC(=O)O5)C
InChI Key
WUVPAYPBMZMHJO-IMNLCBETSA-N
Boiling Point
579.346ºC at 760 mmHg
Flash Point
248.372ºC
Density
1.187g/cm³
Exact Mass
428.25600
H-Bond Acceptor
5
H-Bond Donor
0
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