RU 26988

(8S,9S,10R,11S,13S,14S,17S)-11,17-dihydroxy-10,13-dimethyl-17-prop-1-ynyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-3-one

Also Known As: RU 26988|GTPL3446|(8S,9S,10R,11S,13S,14S,17S)-11,17-dihydroxy-10,13-dimethyl-17-prop-1-ynyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-3-one|11,17-Dihydroxy-17-(1-propynyl)-androsta-1,4,6-trien-3-one,(11beta,17beta)|11,17-Dihydroxy-17-pregnane-1,4,6-triene-20-yn-21-methyl-3-one|11beta,17beta-Dihydroxy-17-(1-propynyl)androsta-1,4,6-trien-3-one|Androsta-1,4,6-trien-3-one, 11,17-dihydroxy-17-(1-propynyl)-, (11beta,17beta)-|androsta-1,4,6-trien-3-one, 11,17-dihydroxy-17-(1-propynyl)-,(11|A,17|A)-|(1S,3aS,3bS,9aR,9bS,10S,11aS)-1,10-dihydroxy-9a,11a-dimethyl-1-(prop-1-yn-1-yl)-1H,2H,3H,3aH,3bH,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one|(8S,9S,10R,11S,13S,14S,17S)-11,17-dihydroxy-10,13-dimethyl-17-prop-1-ynyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta(a)phenanthren-3-one

Molecular Formula	C22H26O3
Molecular Weight	338.1882 g/mol
LogP	2.6
Topological Polar Surface Area	57.5 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	1
Exact Mass	338.1882
Monoisotopic Mass	338.1882
Heavy Atoms	25
Complexity	791.0

Chemical Identifiers

CAS Number	78592-91-3
SMILES	CC#C[C@@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2C=CC4=CC(=O)C=C[C@]34C)O)C)O
InChIKey	IXJKSIRTUSUXQC-ZXYIWLIBSA-N