SpectraBase Compound ID | 2FaegKMdiqZ |
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InChI | InChI=1S/C31H54O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h20-21,23-29H,8-19H2,1-7H3/t21-,23?,24+,25+,26+,27-,28+,29+,30+,31-/m1/s1 |
InChIKey | UOLJGJFAVGOXAH-NUPROOALSA-N |
Mol Weight | 458.8 g/mol |
Molecular Formula | C31H54O2 |
Exact Mass | 458.412381 g/mol |
SpectraBase Spectrum ID | LNx9YQ19wDJ |
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Name | 3.beta.-Acetoxy-24.epsilon.-ethyl-5.alpha.-cholestane |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C31H54O2 |
InChI | InChI=1S/C31H54O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h20-21,23-29H,8-19H2,1-7H3/t21-,23?,24+,25+,26+,27-,28+,29+,30+,31-/m1/s1 |
InChIKey | UOLJGJFAVGOXAH-NUPROOALSA-N |
Molecular Weight | 458.771 g/mol |
SMILES | [C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC[C@](OC(=O)C)(C4)[H])C)[H])[H])(CC[C@@]1([C@@](CCC(C(C)C)CC)(C)[H])[H])[H])C |
SPLASH | splash10-014i-0093100000-1f07e9c83dbdc48ec056 |
Source of Spectrum | X4-17-422-0 |
Wiley ID | 1585445 |