(2'S,5'S,8'R,9'S,10'S,13'R,14'S,17'R)-2',10',13'-trimethyl-17'-[(2R)-6-methylheptan-2-yl]spiro[1,3-dioxolane-2,3'-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene]-2'-ol

Systemtic Name: (2'S,5'S,8'R,9'S,10'S,13'R,14'S,17'R)-2',10',13'-trimethyl-17'-[(2R)-6-methylheptan-2-yl]spiro[1,3-dioxolane-2,3'-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene]-2'-ol Openeye Name: (2'S,5'S,8'R,9'S,10'S,13'R,14'S,17'R)-17'-[(1R)-1,5-dimethylhexyl]-2',10',13'-trimethyl-spiro[1,3-dioxolane-2,3'-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene]-2'-ol CAS Name: (2'S,5'S,8'R,9'S,10'S,13'R,14'S,17'R)-2',10',13'-trimethyl-17'-[(2R)-6-methylheptan-2-yl]-2'-spiro[1,3-dioxolane-2,3'-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene]ol IUPAC Name: (2'S,5'S,8'R,9'S,10'S,13'R,14'S,17'R)-2',10',13'-trimethyl-17'-[(2R)-6-methylheptan-2-yl]spiro[1,3-dioxolane-2,3'-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene]-2'-ol Traditional Name: (2'S,5'S,8'R,9'S,10'S,13'R,14'S,17'R)-17'-[(1R)-1,5-dimethylhexyl]-2',10',13'-trimethyl-spiro[1,3-dioxolane-2,3'-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene]-2'-ol Formula: C30H52O3 MolecularWeight: 460.73208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CC(C5(C4)OCCO5)(C)O)C)C

Isomeric SMILES

C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(C[C@](C5(C4)OCCO5)(C)O)C)C

InChI

InChI=1S/C30H52O3/c1-20(2)8-7-9-21(3)24-12-13-25-23-11-10-22-18-30(32-16-17-33-30)29(6,31)19-28(22,5)26(23)14-15-27(24,25)4/h20-26,31H,7-19H2,1-6H3/t21-,22+,23+,24-,25+,26+,27-,28+,29+/m1/s1