| CAS Number | 75803-39-3 |
| Catalog Number | AG005UI5(AGN-PC-0U8ET6) |
| Chemical Name | Ethynyl estradiol 17-b-D-glucuronide |
| IUPAC Name | (2S,3S,4S,5R,6S)-6-[[(8R,9S,13S,14S,17R)-17-ethynyl-3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid |
| InChI | InChI=1S/C26H32O8/c1-3-26(34-24-21(30)19(28)20(29)22(33-24)23(31)32)11-9-18-17-6-4-13-12-14(27)5-7-15(13)16(17)8-10-25(18,26)2/h1,5,7,12,16-22,24,27-30H,4,6,8-11H2,2H3,(H,31,32)/t16-,17-,18+,19+,20+,21-,22+,24+,25+,26+/m1/s1 |
| InChI Key | SQQXJBRONRGLRT-LPVANVSSSA-N |
| MDL Number | MFCD18252568 |
| Molecular Formula | C26H32O8 |
| Molecular Weight | 472.5275 |
| SMILES | C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@]2(O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(=O)O)C#C |
| Synonyms | 17 alpha-ethynylestradiol-17 beta-D-glucopyranosiduronic acid,
17-EEGP,
Ethynyl estradiol 17-b-D-glucuronide,
17 Alpha-ethynylestradiol-17 Beta-d-glucopyranosiduronic Acid,
75803-39-3,
ethynyl estradiol glucuronide,
ZINC31291933,
17-Eegp,
ethinyl estradiol glucuronide,
C024860,
17alpha-Ethynylestradiol-17beta-D-glucopyranosiduronic acid,
17alpha-ethynylestradiol-17beta-D-glucopyranosiduronicacid,
|