methyl 2-[(2S,4bS,7R,8aS)-2,4b-dimethyl-7-[(2-methylpropan-2-yl)oxy]-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-2-yl]ethanoate

Systemtic Name: methyl 2-[(2S,4bS,7R,8aS)-2,4b-dimethyl-7-[(2-methylpropan-2-yl)oxy]-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-2-yl]ethanoate Openeye Name: methyl 2-[(2S,4bS,7R,8aS)-7-tert-butoxy-2,4b-dimethyl-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-2-yl]acetate CAS Name: 2-[(2S,4bS,7R,8aS)-2,4b-dimethyl-7-[(2-methylpropan-2-yl)oxy]-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-2-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2S,4bS,7R,8aS)-2,4b-dimethyl-7-[(2-methylpropan-2-yl)oxy]-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-2-yl]acetate Traditional Name: 2-[(2S,4bS,7R,8aS)-7-tert-butoxy-2,4b-dimethyl-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-2-yl]acetic acid methyl ester Formula: C23H40O3 MolecularWeight: 364.5619

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2C(C1)CCC3C2(CCC(C3)OC(C)(C)C)C)CC(=O)OC

Isomeric SMILES

C[C@@]1(CCC2C(C1)CC[C@@H]3[C@@]2(CC[C@H](C3)OC(C)(C)C)C)CC(=O)OC

InChI

InChI=1S/C23H40O3/c1-21(2,3)26-18-9-12-23(5)17(13-18)8-7-16-14-22(4,11-10-19(16)23)15-20(24)25-6/h16-19H,7-15H2,1-6H3/t16?,17-,18+,19?,22-,23-/m0/s1