17,20,21-Trihydroxypregn-4-en-3-one, (20R)-

(8R,9S,10R,13S,14S,17R)-17-[(1R)-1,2-dihydroxyethyl]-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one

Also Known As: 17alpha-Pregnenetriolone|17,20,21-Trihydroxypregn-4-en-3-one, (20R)-|4-Pregnene-17alpha,20beta,21-triol-3-one|4-Pregnene-17alpha,20beta,21-triol-3-one [MI]|Pregn-4-en-3-one, 17,20,21-trihydroxy-, (20R)-|(20R)-17,20,21-Trihydroxypregn-4-en-3-one|17,20,21-THP|17,20beta,21-trihydroxy-4-pregnen-3-one|17-(1,2-Dihydroxyethyl)-delta4-androsten-3-ON-17alpha-ol|4-Pregnene-17-alpha,20beta,21-triol-3-one|(20R)-17,20,21-Trihydroxy-pregn-4-en-3-one|(20R)-17,20,21-Trihydroxy-pregna-4-ene-3-one|4-PREGNENE-17.ALPHA.,20.BETA.,21-TRIOL-3-ONE|(20R)-17alpha,20,21-Trihydroxypregna-4-ene-3-one|4-PREGNENE-17.ALPHA.,20.BETA.,21-TRIOL-3-ONE [MI]|(8R,9S,10R,13S,14S,17R)-17-[(1R)-1,2-dihydroxyethyl]-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one|17-(1,2-DIHYDROXYETHYL)-.DELTA.4-ANDROSTEN-3-ON-17.ALPHA.-OL|17-(1,2-dihydroxyethyl)-delta-4-androsten-3-on-17-alpha-ol|(1R,3aS,3bR,9aR,9bS,11aS)-1-[(1R)-1,2-dihydroxyethyl]-1-hydroxy-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one

Molecular Formula	C21H32O4
Molecular Weight	348.23007 g/mol
LogP	2.6026
Topological Polar Surface Area	77.76 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	348.23007
Monoisotopic Mass	348.23007
Heavy Atoms	25
Complexity	613.01733

Chemical Identifiers

CAS Number	128-19-8
SMILES	C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@]4([C@@H](CO)O)O)C