| SpectraBase Spectrum ID |
F1KC5WnW101 |
| Name |
4-keto-4-[[(10R,13S)-3-keto-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]oxy]butyric acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H32O5 |
| InChI |
InChI=1S/C23H32O5/c1-22-11-9-15(24)13-14(22)3-4-16-17-5-6-19(23(17,2)12-10-18(16)22)28-21(27)8-7-20(25)26/h13,16-19H,3-12H2,1-2H3,(H,25,26)/t16?,17?,18?,19?,22-,23-/m0/s1 |
| InChIKey |
CJQNBXFUHQZFOE-ANUSRGAUSA-N |
| Molecular Weight |
388.504 g/mol |
| SMILES |
OC(CCC(OC1[C@]2(CCC3[C@@]4(C(=CC(CC4)=O)CCC3C2CC1)C)C)=O)=O |
| SPLASH |
splash10-0pbd-9721000000-7619b3e7b26374ac1ffc |
| Source of Spectrum |
D8-328-274-2 |
| Synonyms |
4-Oxo-4-[(3-oxoandrost-4-en-17-yl)oxy]butanoic acid
4-[[(10R,13S)-10,13-dimethyl-3-oxidanylidene-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]oxy]-4-oxidanylidene-butanoic acid
4-[[(10R,13S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]oxy]-4-oxo-butanoic acid |
| Wiley ID |
1515810 |
![4-keto-4-[[(10R,13S)-3-keto-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]oxy]butyric acid](/api/spectrum/F1KC5WnW101/structure.png?h=300&w=458 "4-keto-4-[[(10R,13S)-3-keto-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]oxy]butyric acid")
