Estriol Tripropionate

[(8R,9S,13S,14S,16R,17R)-13-methyl-3,17-di(propanoyloxy)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-16-yl] propanoate

Also Known As: estriol tripropionate|estriol|Estriol (TN)|Estriol, tripropionate|ESTRIOL PROPIONATE|ESTRIEL-DEPOT|Estriol tripropionate (JAN)|EINECS 218-798-6|ESTRIOL TRIPROPIONATE [JAN]|ESTRIOL TRIPROPIONATE [WHO-DD]|Tox21_113694|NCGC00249918-01|CAS-2236-31-9|Estra-1,3,5(10)-triene-3,16alpha,17beta-triol tripropionate|[(8R,9S,13S,14S,16R,17R)-13-methyl-3,17-di(propanoyloxy)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-16-yl] propanoate|estra-1,3,5 -triene-3,16alpha,17beta-trioltripropionate|1,3,5(10)-Estratriene-3,16alpha,17beta-triol tripropionate|3,16alpha,17beta-Tris(propionyloxy)-1,3,5(10)-estratriene|ESTRA-1,3,5(10)-TRIENE-3,16.ALPHA.,17.BETA.-TRIOL TRIPROPIONATE|ESTRA-1,3,5(10)-TRIENE-3,16,17-TRIOL, TRIPROPANOATE, (16.ALPHA.,17.BETA.)-|16alpha,17beta-Estra-1,3,5(10)-triene-3,16,17-triyl tripropanoate|ESTRA-1,3,5(10)-TRIENE-3,16,17-TRIOL, TRIPROPANOATE, (16ALPHA,17BETA)-|(1R,2R,3aS,3bR,9bS,11aS)-11a-methyl-1,7-bis(propanoyloxy)-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta(a)phenanthren-2-yl propanoate|(1R,2R,3aS,3bR,9bS,11aS)-11a-methyl-1,7-bis(propanoyloxy)-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-2-yl propanoate|(1R,2R,3aS,3bR,9bS,11aS)-11a-methyl-2,7-bis(propanoyloxy)-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl propanoate|218-798-6

Molecular Formula	C27H36O6
Molecular Weight	456.2512 g/mol
LogP	5.11
Topological Polar Surface Area	78.9 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	456.2512
Heavy Atoms	33
Complexity	923.2

Chemical Identifiers

CAS Number	2236-31-9
SMILES	CCC(=O)O[C@@H]1C[C@H]2[C@@H]3CCC4=C([C@H]3CC[C@@]2([C@H]1OC(=O)CC)C)C=CC(=C4)OC(=O)CC