12,15-Dihydroxypregn-4-ene-3,20-dione, (12beta,15alpha)-

(8R,9S,10R,12R,13S,14S,15S,17S)-17-acetyl-12,15-dihydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

Also Known As: 12beta,15alpha-Dihydroxyprogesterone|KST-1A7274|12-beta,15-alpha-Dihydroxypregn-4-ene-3,20-dione|(12beta,15alpha)-12,15-Dihydroxypregn-4-ene-3,20-dione|12,15-Dihydroxypregn-4-ene-3,20-dione, (12beta,15alpha)-|12beta,15alpha-Dihydroxypregna-4-ene-3,20-dione|(12|A,15|A)-12,15-dihydroxypregn-4-ene-3,20-dione|Pregn-4-ene-3,20-dione, 12,15-dihydroxy-, (12beta,15alpha)-|(12.BETA.,15.ALPHA.)-12,15-DIHYDROXYPREGN-4-ENE-3,20-DIONE|12,15-DIHYDROXYPREGN-4-ENE-3,20-DIONE, (12.BETA.,15.ALPHA.)-|PREGN-4-ENE-3,20-DIONE, 12,15-DIHYDROXY-, (12.BETA.,15.ALPHA.)-|(1S,3S,3aS,3bR,9aR,9bS,11R,11aS)-1-acetyl-3,11-dihydroxy-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one|(8R,9S,10R,12R,13S,14S,15S,17S)-17-acetyl-12,15-dihydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

Molecular Formula	C21H30O4
Molecular Weight	346.21442 g/mol
LogP	1.5
Topological Polar Surface Area	74.6 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	1
Exact Mass	346.21442
Monoisotopic Mass	346.21442
Heavy Atoms	25
Complexity	652.0

Chemical Identifiers

CAS Number	599-14-4
SMILES	CC(=O)[C@H]1C[C@@H]([C@@H]2[C@@]1([C@@H](C[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C)O
InChIKey	LCDAMWASKLSANR-VJKOAXELSA-N