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(4R)-4-[(3R,5R,8S,9S,10R,13R,14S,17R)-13-methyl-3-trimethylsilyloxy-10-(trimethylsilyloxymethyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid methyl ester
SpectraBase Compound ID GFv37e88kLa
InChI InChI=1S/C31H58O4Si2/c1-22(10-15-29(32)33-3)26-13-14-27-25-12-11-23-20-24(35-37(7,8)9)16-19-31(23,21-34-36(4,5)6)28(25)17-18-30(26,27)2/h22-28H,10-21H2,1-9H3/t22-,23-,24-,25+,26-,27+,28+,30-,31-/m1/s1
InChIKey VEJKJYKYDGWZEI-OTKHIDOWSA-N
Mol Weight 551.0 g/mol
Molecular Formula C31H58O4Si2
Exact Mass 550.387363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L88UigiJYGu
Name (4R)-4-[(3R,5R,8S,9S,10R,13R,14S,17R)-13-methyl-3-trimethylsilyloxy-10-(trimethylsilyloxymethyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid methyl ester
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Formula C31H58O4Si2
InChI InChI=1S/C31H58O4Si2/c1-22(10-15-29(32)33-3)26-13-14-27-25-12-11-23-20-24(35-37(7,8)9)16-19-31(23,21-34-36(4,5)6)28(25)17-18-30(26,27)2/h22-28H,10-21H2,1-9H3/t22-,23-,24-,25+,26-,27+,28+,30-,31-/m1/s1
InChIKey VEJKJYKYDGWZEI-OTKHIDOWSA-N
Molecular Weight 550.971 g/mol
SMILES [C@@]1(CC[C@]2([C@@](C1)(CC[C@]1([C@@]3(CC[C@]([C@@](CCC(=O)OC)(C)[H])([C@@]3(C)CC[C@]21[H])[H])[H])[H])[H])CO[Si](C)(C)C)(O[Si](C)(C)C)[H]
SPLASH splash10-0a4i-0009000000-a561d00c7cef5426a2a2
Source of Spectrum E1-43-1553-0
Synonyms (4R)-4-[(3R,5R,8S,9S,10R,13R,14S,17R)-13-methyl-3-trimethylsilyloxy-10-(trimethylsilyloxymethyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]valeric acid methyl ester Methyl (4R)-4-[(3R,5R,8S,9S,10R,13R,14S,17R)-13-methyl-3-trimethylsilyloxy-10-(trimethylsilyloxymethyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
Wiley ID 1553066