Scilliglaucosidine

(8R,9S,10S,13R,14S,17R)-14-hydroxy-13-methyl-3-oxo-17-(6-oxopyran-3-yl)-2,6,7,8,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde

Also Known As: Scilliglaucosidine|Scilliglaucosidone|3-Dehydroscilliglaucosidin|Scilliglaucosidin, 3-dehydro-|3,19-Dioxo-14-hydroxybufa-4,20,22-trienolide|14-Hydroxy-3,19-dioxobufa-4,20,22-trienolide|BUFA-4,20,22-TRIENOLIDE, 3,19-DIOXO-14-HYDROXY-|(8R,9S,10S,13R,14S,17R)-14-hydroxy-13-methyl-3-oxo-17-(6-oxopyran-3-yl)-2,6,7,8,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde|(1R,3aS,3bR,9aS,9bS,11aR)-3a-hydroxy-11a-methyl-7-oxo-1-(2-oxo-2H-pyran-5-yl)-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-9a-carbaldehyde|(8R,9S,10S,13R,14S,17R)-14-hydroxy-13-methyl-3-oxo-17-(6-oxopyran-3-yl)-2,6,7,8,9,11,12,15,16,17-decahydro-1H-cyclopenta(a)phenanthrene-10-carbaldehyde

Molecular Formula	C24H28O5
Molecular Weight	396.19366 g/mol
LogP	3.5492
Topological Polar Surface Area	84.58 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	396.19366
Monoisotopic Mass	396.19366
Heavy Atoms	29
Complexity	939.76776

Chemical Identifiers

CAS Number	21887-06-9
SMILES	C[C@]12CC[C@H]3[C@H]([C@]1(CC[C@@H]2C4=COC(=O)C=C4)O)CCC5=CC(=O)CC[C@]35C=O