Anodyne| 16α-LE2 | |
|---|---|
 | |
| Molecular structure via molpic | |
| Conformer structure via 3Dmol.js | |
| Molecular formula | C20H24O4[1] |
| Molecular mass | 328.4 g/mol[1] |
| Predicted LogP | 3[1] |
| Chirality | absolute[2] |
| Identifiers [] | |
|---|---|
| IUPAC name | (1R,2S,4R,8R,9S,12S)-8,16-dihydroxy-9-methyl-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-13(18),14,16-trien-6-one[1] |
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1C[C@@H]4[C@]2(CC(=O)O4)O)CCC5=C3C=CC(=C5)O[1] |
| InChI | InChI=1S/C20H24O4/c1-19-7-6-14-13-5-3-12(21)8-11(13)2-4-15(14)16(19)9-17-20(19,23)10-18(22)24-17/h3,5,8,14-17,21,23H,2,4,6-7,9-10H2,1H3/t14-,15-,16+,17-,19+,20+/m1/s1[1] |
| InChIKey | NLUGVTJBNRSIKH-UQZPWQSVSA-N[1] |
| Dosing |
|---|
16α-Lactone-estradiol
16α-Lactone-estradiol (also known as ZK-281471, 3,17β-Dihydroxy-19-nor-17α-pregna-1,3,5(10)-triene-21,16α-lactone, 19-Norpregna-1,3,5(10)-trien-21-oic acid, 3,16,17-trihydroxy-, γ-lactone, (16α,17α)- or BAY-503)
Chemistry
Stereochemistry
16α-Lactone-estradiol is a absolute mixture