Strophanthidinic acid

(3S,5S,8R,9S,10S,13R,14S,17R)-3,5,14-trihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carboxylic acid

Also Known As: Strophanthidylic acid|Strophanthidinic acid|Strophanthidinoic acid|Strophanthidin-19-carboxylic acid|KST-1A5295|strophanthidine-19-carboxylic acid|(3S,5S,8R,9S,10S,13R,14S,17R)-3,5,14-trihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carboxylic acid|3,5,14,19-tetrahydroxy-19-oxocard-20(22)-enolide|(3|A,5|A)-3,5,14,19-tetrahydroxy-19-oxocard-20(22)-enolide|3beta,5,14,19-Tetrahydroxy-19-oxo-5beta-card-20(22)-enolide|24-Nor-5-beta,14-beta-chol-20(22)-ene-19,23-dioic acid, 3-beta,5,14,21-tetrahydroxy-, gamma-lactone|(1R,3aS,3bR,5aS,7S,9aS,9bS,11aR)-3a,5a,7-trihydroxy-11a-methyl-1-(5-oxo-2,5-dihydrofuran-3-yl)-hexadecahydro-1H-cyclopenta[a]phenanthrene-9a-carboxylic acid|(3S,5S,8R,9S,10S,13R,14S,17R)-3,5,14-trihydroxy-13-methyl-17-(5-oxo-2,5-dihydrofuran-3-yl)hexadecahydro-1H-cyclopenta[a]phenanthrene-10-carboxylic acid|3beta,5,14beta,21-Tetrahydroxy-24-nor-5beta-chol-20(22)-ene-19,23-dioic acid gamma-lactone

Molecular Formula	C23H32O7
Molecular Weight	420.2148 g/mol
LogP	1.78
Topological Polar Surface Area	124.29 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	6
Rotatable Bonds	2
Exact Mass	420.2148
Heavy Atoms	30
Complexity	822.4

Chemical Identifiers

CAS Number	508-64-5
SMILES	C[C@]12CC[C@H]3[C@H]([C@]1(CC[C@@H]2C4=CC(=O)OC4)O)CC[C@]5([C@@]3(CC[C@@H](C5)O)C(=O)O)O