14alpha-Artebufogenin structure

14alpha-Artebufogenin

5-(3-hydroxy-10,13-dimethyl-15-oxo-1,2,3,4,5,6,7,8,9,11,12,14,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pyran-2-one

Also Known As: 14alpha-Artebufogenin|14.alpha.-Artebufogenin|3-Hydroxy-15-oxobufa-20,22-dienolide|3-Hydroxy-15-oxobufa-20,22-dienolide #|5.beta.,22-dienolide, 3.beta.-hydroxy-15-oxo-|5.beta.,14.alpha.-Bufa-20,22-dienolide, 3.beta.-hydroxy-15-oxo-|5-(3-hydroxy-10,13-dimethyl-15-oxo-1,2,3,4,5,6,7,8,9,11,12,14,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pyran-2-one|5beta,14alpha-Bufa-20,22-dienolide, 3beta-hydroxy-15-oxo-|Bufa-20,22-dienolide, 3-hydroxy-15-oxo-, (3.beta.,5.beta.,14.alpha.)-|Bufa-20, 3-hydroxy-15-oxo-, (3.beta.,5.beta.,14.alpha.)-|Bufa-20,22-dienolide, 3-hydroxy-15-oxo-, (3beta,5beta,14alpha)-|(3|A-Hydroxy-7-oxo-14|A-methyl-podocarpanyliden-(13seqtrans))-essigsaeure-(2-dimethylamino-aethylester)|5-(3-hydroxy-10,13-dimethyl-15-oxo-1,2,3,4,5,6,7,8,9,11,12,14,16,17-tetradecahydrocyclopenta(a)phenanthren-17-yl)pyran-2-one

CAS: 468-86-0
Molecular Formula C24H32O4
Molecular Weight 384.23007 g/mol
LogP 3.9
Topological Polar Surface Area 63.6 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 1
Exact Mass 384.23007
Monoisotopic Mass 384.23007
Heavy Atoms 28
Complexity 767.0

Chemical Identifiers

CAS Number 468-86-0
SMILES CC12CCC(CC1CCC3C2CCC4(C3C(=O)CC4C5=COC(=O)C=C5)C)O
InChIKey NTLOERPHSXBROY-UHFFFAOYSA-N

Product Overview

14alpha-Artebufogenin (CAS 468-86-0), with molecular formula C24H32O4 and molecular weight 384.23007 g/mol. IUPAC: 5-(3-hydroxy-10,13-dimethyl-15-oxo-1,2,3,4,5,6,7,8,9,11,12,14,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pyran-2-one.

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