methyl (1R,4S,4aS,7R,9R,10aR)-4,9-diacetyloxy-7-ethenyl-1,4a,7-trimethyl-8-oxidanylidene-2,3,4,5,6,9,10,10a-octahydrophenanthrene-1-carboxylate

Systemtic Name: methyl (1R,4S,4aS,7R,9R,10aR)-4,9-diacetyloxy-7-ethenyl-1,4a,7-trimethyl-8-oxidanylidene-2,3,4,5,6,9,10,10a-octahydrophenanthrene-1-carboxylate Openeye Name: methyl (1R,4S,4aS,7R,9R,10aR)-4,9-diacetoxy-1,4a,7-trimethyl-8-oxo-7-vinyl-2,3,4,5,6,9,10,10a-octahydrophenanthrene-1-carboxylate CAS Name: (1R,4S,4aS,7R,9R,10aR)-4,9-diacetyloxy-7-ethenyl-1,4a,7-trimethyl-8-oxo-2,3,4,5,6,9,10,10a-octahydrophenanthrene-1-carboxylic acid methyl ester IUPAC Name: methyl (1R,4S,4aS,7R,9R,10aR)-4,9-diacetyloxy-7-ethenyl-1,4a,7-trimethyl-8-oxo-2,3,4,5,6,9,10,10a-octahydrophenanthrene-1-carboxylate Traditional Name: (1R,4S,4aS,7R,9R,10aR)-4,9-diacetoxy-8-keto-1,4a,7-trimethyl-7-vinyl-2,3,4,5,6,9,10,10a-octahydrophenanthrene-1-carboxylic acid methyl ester Formula: C25H34O7 MolecularWeight: 446.53326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC(C2C1(C3=C(C(C2)OC(=O)C)C(=O)C(CC3)(C)C=C)C)(C)C(=O)OC

Isomeric SMILES

CC(=O)O[C@H]1CC[C@@]([C@H]2[C@]1(C3=C([C@@H](C2)OC(=O)C)C(=O)[C@@](CC3)(C)C=C)C)(C)C(=O)OC

InChI

InChI=1S/C25H34O7/c1-8-23(4)11-9-16-20(21(23)28)17(31-14(2)26)13-18-24(5,22(29)30-7)12-10-19(25(16,18)6)32-15(3)27/h8,17-19H,1,9-13H2,2-7H3/t17-,18+,19+,23+,24-,25-/m1/s1