SpectraBase Compound ID | 12V5HPmrZw6 |
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InChI | InChI=1S/C31H55O5P/c1-20(2)10-9-11-21(3)25-12-13-26-24-19-29(37(33,34-7)35-8)28-18-23(36-22(4)32)14-16-31(28,6)27(24)15-17-30(25,26)5/h20-21,23-29H,9-19H2,1-8H3/t21?,23-,24?,25+,26?,27?,28+,29-,30+,31+/m0/s1 |
InChIKey | SMMWYSLEOLIKIE-WQQMYXRKSA-N |
Mol Weight | 538.7 g/mol |
Molecular Formula | C31H55O5P |
Exact Mass | 538.378712 g/mol |
SpectraBase Spectrum ID | Fmspnlj5yWq |
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Name | 6-[(Dimethoxy)phosphoroso]cholesteryl Acetate |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C31H55O5P |
InChI | InChI=1S/C31H55O5P/c1-20(2)10-9-11-21(3)25-12-13-26-24-19-29(37(33,34-7)35-8)28-18-23(36-22(4)32)14-16-31(28,6)27(24)15-17-30(25,26)5/h20-21,23-29H,9-19H2,1-8H3/t21?,23-,24?,25+,26?,27?,28+,29-,30+,31+/m0/s1 |
InChIKey | SMMWYSLEOLIKIE-WQQMYXRKSA-N |
Molecular Weight | 538.750 g/mol |
SMILES | [C@]12([C@@]([C@@](P(=O)(OC)OC)(CC3C2CC[C@@]2([C@@](C(CCCC(C)C)C)(CCC32)[H])C)[H])(C[C@@](OC(=O)C)(CC1)[H])[H])C |
SPLASH | splash10-016r-0029510000-fdc5b721fe92446c8be2 |
Source of Spectrum | J-58-6842-9 |
Wiley ID | 1404360 |