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17.alpha.-Hydroxy-5.alpha.-stigmastan-3.beta.-yl acetate
SpectraBase Compound ID 8owNP0r5J87
InChI InChI=1S/C31H54O3/c1-8-23(20(2)3)10-9-21(4)31(33)18-15-28-26-12-11-24-19-25(34-22(5)32)13-16-29(24,6)27(26)14-17-30(28,31)7/h20-21,23-28,33H,8-19H2,1-7H3/t21-,23?,24+,25+,26?,27?,28?,29+,30+,31+/m1/s1
InChIKey UUVLHGGMXZYMMD-GXOKEHKNSA-N
Mol Weight 474.8 g/mol
Molecular Formula C31H54O3
Exact Mass 474.407296 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5kVVJjjiOwe
Name 17.alpha.-Hydroxy-5.alpha.-stigmastan-3.beta.-yl acetate
Alternate Name(s) (3beta,5alpha)-17-hydroxystigmastan-3-yl acetate
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Formula C31H54O3
InChI InChI=1S/C31H54O3/c1-8-23(20(2)3)10-9-21(4)31(33)18-15-28-26-12-11-24-19-25(34-22(5)32)13-16-29(24,6)27(26)14-17-30(28,31)7/h20-21,23-28,33H,8-19H2,1-7H3/t21-,23?,24+,25+,26?,27?,28?,29+,30+,31+/m1/s1
InChIKey UUVLHGGMXZYMMD-GXOKEHKNSA-N
Molecular Weight 474.770 g/mol
SMILES O[C@]1([C@@]2(C(C3CC[C@@]4([C@@](C3CC2)(CC[C@](OC(=O)C)(C4)[H])C)[H])CC1)C)[C@@](CCC(C(C)C)CC)(C)[H]
SPLASH splash10-05nb-7079000000-c8828b83690a899d5af9
Source of Spectrum K-2001-2235-32
Wiley ID 1579682