11,18-18,20-Diepoxypregnan-3-ol
(1R,2S,3S,6R,8R,11S,12S,15S,16S)-3,16-dimethyl-17,21-dioxahexacyclo[16.2.1.02,11.03,8.012,19.015,19]henicosan-6-ol
Also Known As: Kelly M1|11,18-18,20-Diepoxypregnan-3-ol|KST-1A6409|A,11|A,13xi,20s)-11,18:18,20-diepoxypregnan-3-ol|(3|A,5|A,11|A,13xi,20s)-11,18:18,20-diepoxypregnan-3-ol|Pregnan-3-ol, 11,18:18,20-diepoxy-, (3alpha,5beta,11beta,20S)-|(13xi,20S)-5beta,11alpha,17alpha-11,18:18,20-Diepoxypregnan-3alpha-ol|(1R,2S,3S,6R,8R,11S,12S,15S,16S)-3,16-dimethyl-17,21-dioxahexacyclo[16.2.1.02,11.03,8.012,19.015,19]henicosan-6-ol|A,5
| Molecular Formula | C21H32O3 |
|---|---|
| Molecular Weight | 332.23514 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 332.23514 |
| Monoisotopic Mass | 332.23514 |
| Heavy Atoms | 24 |
| Complexity | 563.0 |
Chemical Identifiers
| CAS Number | 60175-48-6 |
|---|---|
| SMILES | C[C@H]1[C@H]2CC[C@@H]3C24C[C@H]([C@H]5[C@H]3CC[C@H]6[C@@]5(CC[C@H](C6)O)C)OC4O1 |
| InChIKey | PDRIWHNWBPWLNX-YHAXPTRZSA-N |
Product Overview
11,18-18,20-Diepoxypregnan-3-ol (CAS 60175-48-6), with molecular formula C21H32O3 and molecular weight 332.23514 g/mol. IUPAC: (1R,2S,3S,6R,8R,11S,12S,15S,16S)-3,16-dimethyl-17,21-dioxahexacyclo[16.2.1.02,11.03,8.012,19.015,19]henicosan-6-ol.
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