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(5R,8R,9S,10S,12S,13R,14S,17R)-10,13-dimethyl-17-[(1R)-1-methylpropyl]spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxane]-12-ol
SpectraBase Compound ID 4wOCFsbqGg1
InChI InChI=1S/C26H44O3/c1-5-17(2)20-9-10-21-19-8-7-18-16-26(28-13-6-14-29-26)12-11-24(18,3)22(19)15-23(27)25(20,21)4/h17-23,27H,5-16H2,1-4H3/t17-,18-,19+,20-,21+,22+,23+,24+,25-/m1/s1
InChIKey VVGMSENIPFKKGK-LCLDLZHKSA-N
Mol Weight 404.6 g/mol
Molecular Formula C26H44O3
Exact Mass 404.329045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5HOPFGyBfdR
Name (5R,8R,9S,10S,12S,13R,14S,17R)-10,13-dimethyl-17-[(1R)-1-methylpropyl]spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxane]-12-ol
Alternate Name(s) (5R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-butan-2-yl]-10,13-dimethyl-12-spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxane]ol (5R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-butan-2-yl]-10,13-dimethyl-spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxane]-12-ol
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Formula C26H44O3
InChI InChI=1S/C26H44O3/c1-5-17(2)20-9-10-21-19-8-7-18-16-26(28-13-6-14-29-26)12-11-24(18,3)22(19)15-23(27)25(20,21)4/h17-23,27H,5-16H2,1-4H3/t17-,18-,19+,20-,21+,22+,23+,24+,25-/m1/s1
InChIKey VVGMSENIPFKKGK-LCLDLZHKSA-N
Molecular Weight 404.635 g/mol
SMILES O[C@@]1([C@]2([C@]([C@@]3(CC[C@]4([C@@]([C@]3(C1)[H])(CCC1(OCCCO1)C4)C)[H])[H])(CC[C@@]2([C@@](CC)(C)[H])[H])[H])C)[H]
SPLASH splash10-00fr-0095200000-9938bf76b63da8ff8846
Source of Spectrum KC-0-1956-16
Wiley ID 784155