Products 60134-76-1

CAS 60134-76-1 appears in our catalog under these names: Ethynyl Estradiol 3–β–D–Glucuronide, Ethynyl Estradiol-3-Glucuronide, Ethynyl estradiol 3-b-D-glucuronide. Offered by: GLPBio, Chemat Brand, Biosynth, MedChemExpress. Available pack sizes: 1mg, on request, 500μg, 0,5mg, 2mg, 10mg, 5mg, Get quote.

Structural formula: {0} (CAS {1})

(2S,3S,4S,5R,6S)-6-[[(8R,9S,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid (CAS 60134-76-1) is a chemical compound with the molecular formula C26H32O8 and a molecular weight of 472.5 g/mol. IUPAC name: (2S,3S,4S,5R,6S)-6-[[(8R,9S,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid. InChIKey: DYBBEZHAELJFKW-IWTIIAAJSA-N.

Identity
Molecular formulaC26H32O8
Molecular weight472.5 g/mol
IUPAC name(2S,3S,4S,5R,6S)-6-[[(8R,9S,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyDYBBEZHAELJFKW-IWTIIAAJSA-N
SMILESC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O

Computed by PubChem (NCBI)