| SpectraBase Spectrum ID |
6oMpkOZd2w9 |
| Name |
(3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) acetate |
| CAS Registry Number |
22268-16-2 |
| Comments |
Note: The molecular formula of the structure shown is C21H28O3 - which differs from the formula reported for the mass spectrum (C21H27DO3) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H27DO3 |
| InChI |
InChI=1S/C21H28O3/c1-13(22)24-20-9-8-19-18-6-4-14-12-15(23-3)5-7-16(14)17(18)10-11-21(19,20)2/h5,7,12,17-20H,4,6,8-11H2,1-3H3 |
| InChIKey |
FMNPCVNWRFPDCA-UHFFFAOYSA-N |
| Molecular Weight |
328.452 g/mol |
| SMILES |
c12CCC3C(c2ccc(c1)OC)CCC1(C3CCC1OC(=O)C)C |
| SPLASH |
splash10-00bc-3941000000-6770081290010ec7732a |
| Synonyms |
3-Methoxyestra-1(10),2,4-trien-17-yl acetate
(3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) ethanoate
Acetic acid (3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) ester
Estra-1,3,5(10)-trien-17-ol, 3-methoxy-, acetate, (17.beta.)-(.+-.)- |
| Wiley ID |
1486680 |
![(3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) acetate](/api/spectrum/6oMpkOZd2w9/structure.png?h=300&w=458 "(3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) acetate")
