| SpectraBase Spectrum ID |
IDayMQIzg2G |
| Name |
17.alpha.-(1'-Hydroxy-2'-oxohexyl)-8.alpha.,9.beta.-estra-1,3,5(10)-triene-3,14.beta.-diol |
| Alternate Name(s) |
1-[(8alpha,9beta,14beta,17beta)-3,14-dihydroxyestra-1,3,5(10)-trien-17-yl]-1-hydroxy-2-hexanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H34O4 |
| InChI |
InChI=1S/C24H34O4/c1-3-4-5-21(26)22(27)20-11-13-24(28)19-9-6-15-14-16(25)7-8-17(15)18(19)10-12-23(20,24)2/h7-8,14,18-20,22,25,27-28H,3-6,9-13H2,1-2H3/t18-,19-,20+,22?,23+,24-/m0/s1 |
| InChIKey |
YYDSOINLMXPDSR-JNXYOFFKSA-N |
| Molecular Weight |
386.532 g/mol |
| SMILES |
OC([C@@]1([C@@]2([C@](CC1)([C@@]1([C@@](CC2)(c2ccc(cc2CC1)O)[H])[H])O)C)[H])C(=O)CCCC |
| SPLASH |
splash10-000i-0009000000-24e2b3c4985baf22eb59 |
| Source of Spectrum |
F9-1993-211-26 |
| Wiley ID |
1566694 |
![17-.alpha.-[1'-Hydroxy-2'-oxohexyl]-8.alpha.,9.beta.-estra-1,3,5(10)-triene-3,14.beta.-diol](/api/spectrum/IDayMQIzg2G/structure.png?h=300&w=458 "17-.alpha.-[1'-Hydroxy-2'-oxohexyl]-8.alpha.,9.beta.-estra-1,3,5(10)-triene-3,14.beta.-diol")
