Products 90746-94-4
CAS 90746-94-4 appears in our catalog under these names: 4-Hydroxyestradiol 3-O-Beta-D-Glucuronide, 4-Hydroxyestradiol 3-O-b-D-Glucuronide, 4-Hydroxyestradiol-3-O-b-D-glucuronide. Offered by: TRC, Biosynth. Available pack sizes: 1mg, 2,5mg, 5mg, 2mg.
4-hydroxy-17beta-estradiol 3-O-(beta-D-glucuronide) is a steroid glucosiduronic acid that is 4-hydroxy-17beta-estradiol having a single beta-D-glucuronic acid residue attached at position 3. It is a beta-D-glucosiduronic acid, a steroid glucosiduronic acid, a 17beta-hydroxy steroid and a 4-hydroxy steroid. It is functionally related to a 4-hydroxy-17beta-estradiol. It is a conjugate acid of a 4-hydroxy-17beta-estradiol 3-O-(beta-D-glucuronide)(1-).
Source: ChEBI
| Molecular formula | C24H32O9 |
|---|---|
| Molecular weight | 464.5 g/mol |
| IUPAC name | (2S,3S,4S,5R,6S)-6-[[(8R,9S,13S,14S,17S)-4,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid |
| InChIKey | HGCOILRQOIIUJW-ICTMVFLBSA-N |
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O |
Computed by PubChem (NCBI)
Synonyms:
4-Hydroxyestradiol 3-O-b-D-Glucuronide, 4-Hydroxyestradiol 3-O-Beta-D-Glucuronide, 4-hydroxyestradiol 3-glucuronide, 4-hydroxy-17beta-estradiol 3-glucuronide, 4-hydroxy-17beta-estradiol 3-beta-glucuronide, 4-hydroxy-17beta-estradiol 3-(beta-D-glucuronide), 4-hydroxy-17beta-estradiol 3-O-(beta-D-glucuronide), 4,17beta-dihydroxyestra-1(10),2,4-trien-3-yl beta-D-glucopyranosiduronic acid