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2-[2-[(8R,9S,13S,14S,17R)-3-[tert-butyl(dimethyl)silyl]oxy-13-methyl-17-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethyl]isoindole-1,3-dione
SpectraBase Compound ID CZhPpMB7xuE
InChI InChI=1S/C34H45NO4Si/c1-32(2,3)40(5,6)39-23-12-14-24-22(21-23)11-13-26-25(24)15-17-33(4)29(26)16-18-34(33,38)19-20-35-30(36)27-9-7-8-10-28(27)31(35)37/h7-10,12,14,21,25-26,29,38H,11,13,15-20H2,1-6H3/t25-,26-,29+,33+,34-/m1/s1
InChIKey ABLGVWSJKFWNHD-YVWPKHACSA-N
Mol Weight 559.8 g/mol
Molecular Formula C34H45NO4Si
Exact Mass 559.311785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BdacAAGui4s
Name 2-[2-[(8R,9S,13S,14S,17R)-3-[tert-butyl(dimethyl)silyl]oxy-13-methyl-17-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethyl]isoindole-1,3-dione
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Formula C34H45NO4Si
InChI InChI=1S/C34H45NO4Si/c1-32(2,3)40(5,6)39-23-12-14-24-22(21-23)11-13-26-25(24)15-17-33(4)29(26)16-18-34(33,38)19-20-35-30(36)27-9-7-8-10-28(27)31(35)37/h7-10,12,14,21,25-26,29,38H,11,13,15-20H2,1-6H3/t25-,26-,29+,33+,34-/m1/s1
InChIKey ABLGVWSJKFWNHD-YVWPKHACSA-N
Molecular Weight 559.822 g/mol
SMILES O[C@@]1([C@@]2([C@@]([C@@]3(CCc4c([C@]3(CC2)[H])ccc(O[Si](C(C)(C)C)(C)C)c4)[H])([H])CC1)C)CCN1C(c2ccccc2C1=O)=O
SPLASH splash10-0zfu-0001090000-a36ccea337a33930ebb1
Source of Spectrum E1-38-2347-11
Synonyms 2-[2-[(8R,9S,13S,14S,17R)-3-[tert-butyl(dimethyl)silyl]oxy-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethyl]isoindole-1,3-dione 2-[2-[(8R,9S,13S,14S,17R)-3-[tert-butyl(dimethyl)silyl]oxy-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethyl]isoindoline-1,3-dione 2-[2-[(8R,9S,13S,14S,17R)-3-[tert-butyl(dimethyl)silyl]oxy-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]ethyl]isoindoline-1,3-quinone
Wiley ID 1598402