SpectraBase Spectrum ID |
HlTUqT7ltI6 |
Name |
3-[3'-(Hydroxy)estra-1',3',5'(10')-trien-17'-yloxy]propyl benzoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C28H34O4 |
InChI |
InChI=1S/C28H34O4/c1-28-15-14-23-22-11-9-21(29)18-20(22)8-10-24(23)25(28)12-13-26(28)31-16-5-17-32-27(30)19-6-3-2-4-7-19/h2-4,6-7,9,11,18,23-26,29H,5,8,10,12-17H2,1H3/t23?,24?,25?,26?,28-/m0/s1 |
InChIKey |
RRVNDZNSEAIPSD-WAKJXLRYSA-N |
Molecular Weight |
434.576 g/mol |
SMILES |
Oc1cc2c(C3CC[C@]4(C(C3CC2)CCC4OCCCOC(=O)c2ccccc2)C)cc1 |
SPLASH |
splash10-0nn9-0940200000-5fdb4de848973946664e |
Source of Spectrum |
U-1995-1627-25 |
Synonyms |
3-{[3-hydroxyestra-1,3,5(10)-trien-17-yl]oxy}propyl benzoate |
Wiley ID |
767637 |