| SpectraBase Spectrum ID |
B4FRLOo5fyS |
| Name |
Estradiol |
| Alternate Name(s) |
Estra-1,3,5(10)-triene-3,17.beta.-diol
(8R,9S,13S,14S,17S)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H24O2 |
| InChI |
InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1 |
| InChIKey |
VOXZDWNPVJITMN-ZBRFXRBCSA-N |
| Molecular Weight |
272.388 g/mol |
| SMILES |
Oc1cc2CC[C@]3([C@@]4(CC[C@@]([C@]4(CC[C@@]3(c2cc1)[H])C)(O)[H])[H])[H] |
| SPLASH |
splash10-075a-2920000000-2eb48df2e4b65a7971d6 |
| Source of Spectrum |
SWG-33-1694-0 |
| Wiley ID |
1809323 |
