Cyclotriol | |
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Molecular structure via molpic | |
Conformer structure via 3Dmol.js | |
Molecular formula | C20H26O3[1] |
Molecular mass | 314.4 g/mol[1] |
Predicted LogP | 3.1[1] |
Chirality | absolute[2] |
Identifiers [] | |
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IUPAC name | (1S,2R,11S,14S,15R,16R)-14-methylpentacyclo[13.2.2.01,14.02,11.05,10]nonadeca-5(10),6,8-triene-7,15,16-triol[1] |
SMILES | C[C@]12CC[C@H]3[C@H]([C@@]14CC[C@@]2([C@@H](C4)O)O)CCC5=C3C=CC(=C5)O[1] |
InChI | InChI=1S/C20H26O3/c1-18-7-6-15-14-4-3-13(21)10-12(14)2-5-16(15)19(18)8-9-20(18,23)17(22)11-19/h3-4,10,15-17,21-23H,2,5-9,11H2,1H3/t15-,16-,17-,18+,19+,20+/m1/s1[1] |
InChIKey | PAMNOUDFJQSYMD-MUJBESKKSA-N[1] |
Dosing | |
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Elimination half-life | 12.3 hours |
Cyclotriol
Cyclotriol (also known as Zk 136295, ZK-136295, 14,21-Cyclo-19-norpregna-1,3,5(10)-triene-3,16,17-triol, (16-α,17-α)-, CCRIS 6527, 14α,17α-Ethano-1,3,5(10)-estratriene-3,16α,17-β-triol, (16-α,17-α)-14,21-Cyclo-19-norpregna-1,3,5(10)-triene-3,16,17-triol, Zk-136295, (+)-, (16α,17α)-14,21-Cyclo-19-norpregna-1,3,5(10)-triene-3,16,17-triol, 14,17α-Ethano-1,3,5(10)-estratriene-3,16α,17β-triol or 14,21-Cyclo-19-norpregna-1,3,5(10)-triene-3,16,17-triol, (16α,17α)-) is a substance of the steroid class.
Chemistry
Stereochemistry
Cyclotriol is a absolute mixture