2-[(3S,3aS,5R,5aR,7S,9aS,9bS)-3-(1-hydroxyethyl)-3a-methyl-5-oxidanyl-1,2,3,4,5,5a,6,7,8,9,9a,9b-dodecahydrocyclopenta[a]naphthalen-7-yl]ethyl 2,2-dimethylpropanoate

Systemtic Name: 2-[(3S,3aS,5R,5aR,7S,9aS,9bS)-3-(1-hydroxyethyl)-3a-methyl-5-oxidanyl-1,2,3,4,5,5a,6,7,8,9,9a,9b-dodecahydrocyclopenta[a]naphthalen-7-yl]ethyl 2,2-dimethylpropanoate Openeye Name: 2-[(3S,3aS,5R,5aR,7S,9aS,9bS)-5-hydroxy-3-(1-hydroxyethyl)-3a-methyl-1,2,3,4,5,5a,6,7,8,9,9a,9b-dodecahydrocyclopenta[a]naphthalen-7-yl]ethyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 2-[(3S,3aS,5R,5aR,7S,9aS,9bS)-5-hydroxy-3-(1-hydroxyethyl)-3a-methyl-1,2,3,4,5,5a,6,7,8,9,9a,9b-dodecahydrocyclopenta[a]naphthalen-7-yl]ethyl ester IUPAC Name: 2-[(3S,3aS,5R,5aR,7S,9aS,9bS)-5-hydroxy-3-(1-hydroxyethyl)-3a-methyl-1,2,3,4,5,5a,6,7,8,9,9a,9b-dodecahydrocyclopenta[a]naphthalen-7-yl]ethyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 2-[(3S,3aS,5R,5aR,7S,9aS,9bS)-5-hydroxy-3-(1-hydroxyethyl)-3a-methyl-1,2,3,4,5,5a,6,7,8,9,9a,9b-dodecahydrobenz[e]inden-7-yl]ethyl ester Formula: C23H40O4 MolecularWeight: 380.5613

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCC2C1(CC(C3C2CCC(C3)CCOC(=O)C(C)(C)C)O)C)O

Isomeric SMILES

CC([C@H]1CC[C@@H]2[C@@]1(C[C@H]([C@H]3[C@H]2CC[C@@H](C3)CCOC(=O)C(C)(C)C)O)C)O

InChI

InChI=1S/C23H40O4/c1-14(24)18-8-9-19-16-7-6-15(10-11-27-21(26)22(2,3)4)12-17(16)20(25)13-23(18,19)5/h14-20,24-25H,6-13H2,1-5H3/t14?,15-,16-,17-,18-,19+,20-,23-/m1/s1