SpectraBase Spectrum ID |
E5r3KjmBRgY |
Name |
1,4-Dimethoxy-14-methyl-estra-1,3,5(10),7-tetraen-17-one |
CAS Registry Number |
107648-10-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H26O3 |
InChI |
InChI=1S/C21H26O3/c1-20-12-10-18(22)21(20,2)11-9-13-15(20)6-5-14-16(23-3)7-8-17(24-4)19(13)14/h6-8,13H,5,9-12H2,1-4H3/t13-,20?,21+/m0/s1 |
InChIKey |
ZIPSCBQPNUQTRP-TVBJOMNCSA-N |
Molecular Weight |
326.436 g/mol |
SMILES |
C1=2C3([C@](C(=O)CC3)(C)CC[C@@]1(c1c(ccc(c1CC2)OC)OC)[H])C |
SPLASH |
splash10-004i-0009000000-185303e6402bbfebe476 |
Source of Spectrum |
F-42-3449-10 |
Wiley ID |
1325101 |