Androstane-3,17-diol, 3,17-dipropanoate, (3alpha,5alpha,17beta)- structure

Androstane-3,17-diol, 3,17-dipropanoate, (3alpha,5alpha,17beta)-

[(3R,5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-17-propanoyloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate

Also Known As: Androstane-3,17-diol dipropionate|Androstanediol dipropionate|5alpha-Androstane-3alpha,17beta-diol dipropionate|3a,5a-androstanediol dipropionate|Androstane-3,17-diyl dipropanoate|AI3-52811|5|A-androstane-3|A,17|A-diol dipropionate|5alpha-Androstane-3alpha,17beta-diol, dipropionate|SID:104231705|5.alpha.-Androstane-3.alpha., dipropionate|J2.788.574H|3alpha,5alpha,17beta-Androstane-3,17-diyl dipropanoate|5.alpha.-Androstane-3.alpha.,17.beta.-diol, dipropionate|[(3R,5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-17-propanoyloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate|Androstane-3,17-diol, dipropanoate, (3alpha,5alpha,17beta)-|5.ALPHA.-ANDROSTANE-3.ALPHA.,17.BETA.-DIOL DIPROPIONATE|androstane-3,17-diol dipropionate, (3beta,5alpha,17beta)-isomer|Androstane-3,17-diol, 3,17-dipropanoate, (3alpha,5alpha,17beta)-|ANDROSTANE-3,17-DIOL, 3,17-DIPROPANOATE, (3.ALPHA.,5.ALPHA.,17.BETA.)-|(1S,3aS,3bR,5aS,7R,9aS,9bS,11aS)-9a,11a-dimethyl-7-(propanoyloxy)-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl propanoate

CAS: 4723-89-1
Molecular Formula C25H40O4
Molecular Weight 404.29266 g/mol
LogP 6.2
Topological Polar Surface Area 52.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 6
Exact Mass 404.29266
Monoisotopic Mass 404.29266
Heavy Atoms 29
Complexity 645.0

Chemical Identifiers

CAS Number 4723-89-1
SMILES CCC(=O)O[C@@H]1CC[C@]2([C@H](C1)CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4OC(=O)CC)C)C
InChIKey FWAYUWSHYLKUEY-LFWYWRBCSA-N

Product Overview

Androstane-3,17-diol, 3,17-dipropanoate, (3alpha,5alpha,17beta)- (CAS 4723-89-1), with molecular formula C25H40O4 and molecular weight 404.29266 g/mol. IUPAC: [(3R,5S,8R,9S,10S,13S,14S,17S)-10,13-dimethyl-17-propanoyloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] propanoate.

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