methyl (1S,4aR,8R,8aR)-8-(hydroxymethyl)-1,4a,7,8a-tetramethyl-3,4,4b,5,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate

Systemtic Name: methyl (1S,4aR,8R,8aR)-8-(hydroxymethyl)-1,4a,7,8a-tetramethyl-3,4,4b,5,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate Openeye Name: methyl (1S,4aR,8R,8aR)-8-(hydroxymethyl)-1,4a,7,8a-tetramethyl-3,4,4b,5,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate CAS Name: (1S,4aR,8R,8aR)-8-(hydroxymethyl)-1,4a,7,8a-tetramethyl-3,4,4b,5,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester IUPAC Name: methyl (1S,4aR,8R,8aR)-8-(hydroxymethyl)-1,4a,7,8a-tetramethyl-3,4,4b,5,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate Traditional Name: (1S,4aR,8R,8aR)-1,4a,7,8a-tetramethyl-8-methylol-3,4,4b,5,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2C3(CCCC(C3CCC2(C1CO)C)(C)C(=O)OC)C

Isomeric SMILES

CC1=CCC2[C@]([C@@H]1CO)(CCC3[C@@]2(CCC[C@]3(C)C(=O)OC)C)C

InChI

InChI=1S/C21H34O3/c1-14-7-8-16-19(2,15(14)13-22)12-9-17-20(16,3)10-6-11-21(17,4)18(23)24-5/h7,15-17,22H,6,8-13H2,1-5H3/t15-,16?,17?,19+,20-,21+/m1/s1