Cyclodiol
(2R,11S,14S)-14-methylpentacyclo[13.2.2.01,14.02,11.05,10]nonadeca-5(10),6,8-triene-7,15-diol
Also Known As: Cyclodiol|Zk 115194|14,17-Ethano-17beta-estradiol|14,21-Cyclo-19-norpregna-1,3,5(10)-triene-3,17-diol|14,21-Cyclo-19-norpregn-1,3,5(10)-triene-3,11-diol|14,17-ethano-estra-1,3,5(10)-trien-3,17-diol|(14xi,17xi)-14,21-Cyclo-19-norpregna-1(10),2,4-triene-3,17-diol|(2R,11S,14S)-14-Methylpentacyclo[13.2.2.01,14.02,11.05,10]no|(2R,11S,14S)-14-methylpentacyclo[13.2.2.01,14.02,11.05,10]nonadeca-5(10),6,8-triene-7,15-diol|14,17.ALPHA.-ETHANO-1,3,5(10)-ESTRATRIENE-3,17.BETA.-DIOL|(2R,11S,14S)-14-Methylpentacyclo[13.2.2.01,14.02,11.05,10]nonadeca-5,7,9-triene-7,15-diol|(2R,11S,14S,15S)-14-methylpentacyclo[13.2.2.01,14.02,11.05,10]nonadeca-5,7,9-triene-7,15-diol|14,17-Ethano-14H-cyclopenta(a)phenanthrene, 14,21-cyclo-19-norpregna-1,3,5(10)-triene-3,17-diol deriv|14,17-Ethano-14H-cyclopenta(a)phenanthrene, 14,21-cyclo-19-norpregna-1,3,5(10)-triene-3,17-diol deriv.
| Molecular Formula | C20H26O2 |
|---|---|
| Molecular Weight | 298.19327 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 298.19327 |
| Monoisotopic Mass | 298.19327 |
| Heavy Atoms | 22 |
| Complexity | 478.0 |
Chemical Identifiers
| CAS Number | 116229-13-1 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H](C14CCC2(CC4)O)CCC5=C3C=CC(=C5)O |
| InChIKey | YGXXZMDWSWSCSI-UYUJGIFYSA-N |
Product Overview
Cyclodiol (CAS 116229-13-1), with molecular formula C20H26O2 and molecular weight 298.19327 g/mol. IUPAC: (2R,11S,14S)-14-methylpentacyclo[13.2.2.01,14.02,11.05,10]nonadeca-5(10),6,8-triene-7,15-diol.
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