Androstane-3alpha,17beta-diol 17-Glucuronide

cas: 95237-44-8 — see every product listed under this CAS number, including other names

Androstane-3alpha,17beta-diol 17-Glucuronide (CAS 95237-44-8) is a chemical reagent available from Chemat. Available pack sizes: 100mg. Offered by: TRC.

brandTRC
catalog numberTRC-A637905-100MG
cas95237-44-8
size100mg
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delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

5alpha-androstane-3alpha,17beta-diol 17-glucosiduronic acid is a steroid glucosiduronic that is 5alpha-androstane-3alpha,17beta-diol carrying a glucosiduronic acid residue at position 17. It is a steroid glucosiduronic acid and a 3alpha-hydroxy steroid. It is functionally related to a 5alpha-androstane-3alpha,17beta-diol. It is a conjugate acid of a 5alpha-androstane-3alpha,17beta-diol 17-glucosiduronate.

Source: ChEBI

Identity
Molecular formulaC25H40O8
Molecular weight468.6 g/mol
IUPAC name(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(3R,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]oxy]oxane-2-carboxylic acid
InChIKeyZJYZOWMDMWQJIV-WWLGJQRMSA-N
SMILESC[C@]12CC[C@H](C[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@H]4O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O)C)O

Computed by PubChem (NCBI)

Synonyms: androstanediol-17g, 5alpha-androstane-3alpha,17beta-diol 17-glucuronide, 3alpha-hydroxy-5alpha-androstan-17beta-yl beta-D-glucopyranosiduronic acid, Androstane-3?,17?-diol 17-Glucuronide, 5?-Androstan-3?,17?-diol-17?-glucuronide, 5alpha-androstane-3alpha,17beta-diol 17-glucuronoside, 5alpha-androstane-3alpha,17beta-diol 17-glucosiduronic acid, 5alpa-Androstan-3alpha,17beta-diol-17-beta-glucuronide degrees, (3alpha,5alpha,17beta)-3-hydroxyandrostan-17-yl beta-D-glucopyranosiduronic acid
Related forms of this compound
(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(3R,5S,8R,9S,10S,13S,14S,17S)-2,2,3,4,4-pentadeuterio-3-hydroxy-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]oxy]oxane-2-carboxylic acid C25H40O8
Isomers (same molecular formula)
(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(3R,5S,8R,9S,10S,13S,14S,17S)-17-hydroxy-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 C25H40O8
(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(3R,5S,8R,9S,10S,13S,14S,17S)-2,2,3,4,4-pentadeuterio-17-hydroxy-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]oxane-2-carboxylic acid C25H40O8
(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[(3R,5R,8R,9S,10S,13S,14S,17S)-17-hydroxy-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 C25H40O8

Also listed as

5α-Androstan-3α,17β-diol-17β-glucuronide Biosynth CAS 95237-44-8