(4R,6'S,11'S,14'S,16'R)-2-butyl-6'-fluoranyl-10',13',16'-trimethyl-2,11'-bis(oxidanyl)spiro[1,3-dioxane-4,17'-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene]-3',5-dione

Systemtic Name: (4R,6'S,11'S,14'S,16'R)-2-butyl-6'-fluoranyl-10',13',16'-trimethyl-2,11'-bis(oxidanyl)spiro[1,3-dioxane-4,17'-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene]-3',5-dione Openeye Name: (4R,6'S,11'S,14'S,16'R)-2-butyl-6'-fluoro-2,11'-dihydroxy-10',13',16'-trimethyl-spiro[1,3-dioxane-4,17'-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene]-3',5-dione CAS Name: (4R,6'S,11'S,14'S,16'R)-2-butyl-6'-fluoro-2,11'-dihydroxy-10',13',16'-trimethylspiro[1,3-dioxane-4,17'-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene]-3',5-dione IUPAC Name: (4R,6'S,11'S,14'S,16'R)-2-butyl-6'-fluoro-2,11'-dihydroxy-10',13',16'-trimethylspiro[1,3-dioxane-4,17'-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene]-3',5-dione Traditional Name: (4R,6'S,11'S,14'S,16'R)-2-butyl-6'-fluoro-2,11'-dihydroxy-10',13',16'-trimethyl-spiro[1,3-dioxane-4,17'-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene]-3',5-quinone Formula: C27H37FO6 MolecularWeight: 476.577483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(OCC(=O)C2(O1)C(CC3C2(CC(C4C3CC(C5=CC(=O)C=CC45C)F)O)C)C)O

Isomeric SMILES

CCCCC1(OCC(=O)[C@@]2(O1)[C@@H](C[C@@H]3C2(C[C@@H](C4C3C[C@@H](C5=CC(=O)C=CC45C)F)O)C)C)O

InChI

InChI=1S/C27H37FO6/c1-5-6-8-26(32)33-14-22(31)27(34-26)15(2)10-18-17-12-20(28)19-11-16(29)7-9-24(19,3)23(17)21(30)13-25(18,27)4/h7,9,11,15,17-18,20-21,23,30,32H,5-6,8,10,12-14H2,1-4H3/t15-,17?,18+,20+,21+,23?,24?,25?,26?,27+/m1/s1