Products 1806-98-0

CAS 1806-98-0 appears in our catalog under these names: Estradiol 17-Glucuronide, 17beta-Estradiol 17beta-D-Glucuronide, >95% (HPLC), 3,4,5–Trihydroxy–6–(((8R,9S,13S,14S,17S)–3–hydroxy–13–methyl–7,8,9,11,12,13,14,15,16,17–decahydro–6H–cyclopenta(a)phenanthren–17–yl)oxy)tetrahydro–2H–pyran–2–carboxylic acid, Estradiol 17–(β–D–Glucuronide), Estradiol 17-O-β-D-glucuronide. Offered by: Chemat Brand, TRC, GLPBio, Chemat, Biosynth. Available pack sizes: on request, 50mg, 5mg, 1mg, 10mg, 25mg, 250mg, 100mg.

17beta-estradiol 17-glucosiduronic acid is a steroid glucosiduronic acid that consists of 17beta-estradiol having a beta-glucuronyl residue attached at position 17 via a glycosidic linkage. It is a steroid glucosiduronic acid and a 3-hydroxy steroid. It is functionally related to a 17beta-estradiol. It is a conjugate acid of a 17beta-estradiol 17-glucosiduronate.

Source: ChEBI

Identity
Molecular formulaC24H32O8
Molecular weight448.5 g/mol
IUPAC name(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]oxy]oxane-2-carboxylic acid
InChIKeyMTKNDAQYHASLID-QXYWQCSFSA-N
SMILESC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)CCC5=C3C=CC(=C5)O

Computed by PubChem (NCBI)