methyl (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetyloxy-7-(2-hydroxyethyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate

Systemtic Name: methyl (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetyloxy-7-(2-hydroxyethyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate Openeye Name: methyl (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-(2-hydroxyethyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate CAS Name: (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetyloxy-7-(2-hydroxyethyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid methyl ester IUPAC Name: methyl (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetyloxy-7-(2-hydroxyethyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylate Traditional Name: (1R,4aR,4bS,7R,8S,8aR,10aR)-8-acetoxy-7-(2-hydroxyethyl)-1,4a,7-trimethyl-3,4,4b,5,6,8,8a,9,10,10a-decahydro-2H-phenanthrene-1-carboxylic acid methyl ester Formula: C23H38O5 MolecularWeight: 394.54482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C2CCC3C(C2CCC1(C)CCO)(CCCC3(C)C(=O)OC)C

Isomeric SMILES

CC(=O)O[C@H]1[C@@H]2CC[C@@H]3[C@@]([C@H]2CC[C@]1(C)CCO)(CCC[C@@]3(C)C(=O)OC)C

InChI

InChI=1S/C23H38O5/c1-15(25)28-19-16-7-8-18-22(3,10-6-11-23(18,4)20(26)27-5)17(16)9-12-21(19,2)13-14-24/h16-19,24H,6-14H2,1-5H3/t16-,17+,18-,19+,21-,22-,23-/m1/s1