| SpectraBase Spectrum ID |
GddcaGbYD8l |
| Name |
Methyl 3-oxo-pregna-1,4,17(20)-triene-21-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H30O4 |
| InChI |
InChI=1S/C23H30O4/c1-22-11-9-15(24)13-14(22)5-6-16-17-7-8-19(20(26-3)21(25)27-4)23(17,2)12-10-18(16)22/h9,11,13,16-18H,5-8,10,12H2,1-4H3/b20-19-/t16?,17?,18?,22-,23-/m0/s1 |
| InChIKey |
IRJAGKQCMRDTTI-SEEOQURZSA-N |
| Molecular Weight |
370.489 g/mol |
| SMILES |
[C@@]12(\C(=C\(C(=O)OC)OC)CCC2C2CCC=3[C@@](C2CC1)(C=CC(=O)C3)C)C |
| SPLASH |
splash10-0300-0049000000-69e657075bae7524c32d |
| Source of Spectrum |
U-1993-1284-13 |
| Synonyms |
Methyl (17Z)-20-methoxy-3-oxopregna-1,4,17-trien-21-oate
Methyl 20-methoxy-3-oxo-17a-pregna-1,4,7(20)-triene-21-carboxylate |
| Wiley ID |
765448 |
