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Ethyl (syn)-3-(methoxyimino)-7.alpha.-(ethyldimethylsilyloxy)-5.beta.-cholanoate
SpectraBase Compound ID An9gzSiFm2N
InChI InChI=1S/C31H55NO4Si/c1-9-35-28(33)14-11-21(3)24-12-13-25-29-26(16-18-31(24,25)5)30(4)17-15-23(32-34-6)19-22(30)20-27(29)36-37(7,8)10-2/h21-22,24-27,29H,9-20H2,1-8H3/b32-23+/t21-,22+,24-,25+,26+,27-,29+,30+,31-/m1/s1
InChIKey GBHASRGHXVBUGP-TZEFMONMSA-N
Mol Weight 533.9 g/mol
Molecular Formula C31H55NO4Si
Exact Mass 533.390036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11F0lOIpuNx
Name Ethyl (syn)-3-(methoxyimino)-7.alpha.-(ethyldimethylsilyloxy)-5.beta.-cholanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H55NO4Si
InChI InChI=1S/C31H55NO4Si/c1-9-35-28(33)14-11-21(3)24-12-13-25-29-26(16-18-31(24,25)5)30(4)17-15-23(32-34-6)19-22(30)20-27(29)36-37(7,8)10-2/h21-22,24-27,29H,9-20H2,1-8H3/b32-23+/t21-,22+,24-,25+,26+,27-,29+,30+,31-/m1/s1
InChIKey GBHASRGHXVBUGP-TZEFMONMSA-N
Molecular Weight 533.869 g/mol
SMILES [C@@]12([C@]([C@@]3([C@@](C[C@]4([C@@]([C@]3(CC2)[H])(CC\C(=N/OC)C4)C)[H])(O[Si](CC)(C)C)[H])[H])(CC[C@@]1([C@@](CCC(=O)OCC)(C)[H])[H])[H])C
SPLASH splash10-0002-0009000000-a4319c23b4c4215d6b3c
Source of Spectrum JC-525-31-0
Synonyms Ethyl (anti)-3-(methoxyimino)-7.alpha.-(ethyldimethylsilyloxy)-5.beta.-cholanoate Ethyl (5beta,7alpha)-7-{[ethyl(dimethyl)silyl]oxy}-3-(methoxyimino)cholan-24-oate
Wiley ID 1403720