| SpectraBase Spectrum ID |
7DA30yLASi5 |
| Name |
19-Norpregna-1,3,5(10),17(20)-tetraen-21-oic acid, 20-cyano-3-methoxy-, methyl ester, (17E)- |
| Alternate Name(s) |
Methyl (2E)-cyano[3-methoxyestra-1,3,5(10)-trien-17-ylidene]ethanoate
Methyl ester of (20E)-20-cyan-3-methoxy-19-nor-1,3,5(10),17(20)-pregnatetraen-21-carboxylic acid |
| CAS Registry Number |
68352-09-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H27NO3 |
| InChI |
InChI=1S/C23H27NO3/c1-23-11-10-17-16-7-5-15(26-2)12-14(16)4-6-18(17)20(23)8-9-21(23)19(13-24)22(25)27-3/h5,7,12,17-18,20H,4,6,8-11H2,1-3H3/b21-19+/t17-,18-,20+,23+/m1/s1 |
| InChIKey |
LAMYISQWUACWBR-KFLYPBCNSA-N |
| Molecular Weight |
365.473 g/mol |
| SMILES |
C(\C(=C\1[C@@]2([C@@]([C@@]3(CCc4c([C@]3(CC2)[H])ccc(OC)c4)[H])([H])CC1)C)C#N)(=O)OC |
| SPLASH |
splash10-014i-0927000000-1b95b38eea76236e60a7 |
| Source of Spectrum |
K-111-3100-0 |
| Wiley ID |
1351506 |
