CAS 1852-49-9 appears in our catalog under these names: Pregnanediol 3-O-Glucuronide, Pregnanediol–3–Glucuronide, Pregnanediol 3α-O-β-D-glucuronide, Pregnanediol 3-glucuronide, 98.0%. Offered by: Chemat Brand, GLPBio, Biosynth, MedChemExpress. Available pack sizes: on request, 1mg, 500μg, 2mg, 5mg, 25mg, 10mg, 5 mg.
Pregnanediol-3-glucuronide is a steroid glucosiduronic acid.
Source: ChEBI
| Molecular formula | C27H44O8 |
|---|---|
| Molecular weight | 496.6 g/mol |
| IUPAC name | (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(3R,5R,8R,9S,10S,13S,14S,17S)-17-[(1S)-1-hydroxyethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylic acid |
| InChIKey | ZFFFJLDTCLJDHL-JQYCEVDMSA-N |
| SMILES | C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O)C)C)O |
Computed by PubChem (NCBI)