| SpectraBase Spectrum ID |
57ohj12U9w |
| Name |
19-Norpregna-1,3,5(10),17(20)-tetraene-20-carboxaldehyde, 3-methoxy-, (17Z)- |
| Alternate Name(s) |
(2Z)-2-[3-methoxyestra-1,3,5(10)-trien-17-ylidene]propanal
17-(1'-Formyl-1'-ethylidene)-3-methoxy-1,3,5(10)-estratriene |
| CAS Registry Number |
56561-29-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O2 |
| InChI |
InChI=1S/C22H28O2/c1-14(13-23)20-8-9-21-19-6-4-15-12-16(24-3)5-7-17(15)18(19)10-11-22(20,21)2/h5,7,12-13,18-19,21H,4,6,8-11H2,1-3H3/b20-14-/t18-,19-,21+,22-/m1/s1 |
| InChIKey |
VHTQQPLEKQCEBB-ZOSRORKFSA-N |
| Molecular Weight |
324.464 g/mol |
| SMILES |
[C@@]12(\C(CC[C@]2([C@@]2(CCc3c([C@]2(CC1)[H])ccc(OC)c3)[H])[H])=C/(C=O)C)C |
| SPLASH |
splash10-00di-0912000000-29768ce45c66e87ace79 |
| Source of Spectrum |
C-97-4023-0 |
| Wiley ID |
1323689 |
