| SpectraBase Spectrum ID |
A5IsshkUkqY |
| Name |
dimethyl [1.alpha.-hydroxy-5.alpha.-cholest-2-en-3-yl]phosphonate |
| Alternate Name(s) |
dimethyl (1alpha,5alpha)-1-hydroxycholest-2-en-3-ylphosphonate |
| CAS Registry Number |
128389-16-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H51O4P |
| InChI |
InChI=1S/C29H51O4P/c1-19(2)9-8-10-20(3)24-13-14-25-23-12-11-21-17-22(34(31,32-6)33-7)18-27(30)29(21,5)26(23)15-16-28(24,25)4/h18-21,23-27,30H,8-17H2,1-7H3/t20-,21+,23?,24-,25?,26?,27+,28-,29+/m1/s1 |
| InChIKey |
QASLCGMHQVTKNZ-DOXYTWJJSA-N |
| Molecular Weight |
494.697 g/mol |
| SMILES |
O[C@]1(C=C(P(=O)(OC)OC)C[C@]2([C@]1(C1C(C3CC[C@@]([C@]3(CC1)C)([C@@](CCCC(C)C)(C)[H])[H])CC2)C)[H])[H] |
| SPLASH |
splash10-004l-0900700000-aa88bad66b76c9509006 |
| Source of Spectrum |
K-124-182-0 |
| Wiley ID |
1397963 |
![dimethyl [1.alpha.-hydroxy-5.alpha.-cholest-2-en-3-yl]phosphonate](/api/spectrum/A5IsshkUkqY/structure.png?h=300&w=458 "dimethyl [1.alpha.-hydroxy-5.alpha.-cholest-2-en-3-yl]phosphonate")
