SpectraBase Spectrum ID |
DiWh6fuTnc7 |
Name |
Estra-2,5(10)-diene-1,4,17-trione |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H20O3 |
InChI |
InChI=1S/C18H20O3/c1-18-9-8-11-10(13(18)4-7-16(18)21)2-3-12-14(19)5-6-15(20)17(11)12/h5-6,10-11,13H,2-4,7-9H2,1H3/t10-,11+,13+,18+/m1/s1 |
InChIKey |
OEGSPOKFPURXOI-SXFBXUMFSA-N |
Molecular Weight |
284.355 g/mol |
SMILES |
C1=2[C@@]3([C@@]([C@@]4(CCC([C@]4(CC3)C)=O)[H])([H])CCC2C(=O)C=CC1=O)[H] |
SPLASH |
splash10-0acc-9050000000-ba507019167b53420309 |
Source of Spectrum |
F-53-14080-1 |
Wiley ID |
804080 |