Products 428506-88-1

CAS 428506-88-1 appears in our catalog under these names: 4-Hydroxy Estradiol 1-N3-Adenine, 4-Hydroxy Estradiol 1-N3-Adenine, >95% (HPLC). Offered by: Chemat Brand, TRC. Available pack sizes: on request, 10mg, 1mg.

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

(8R,9S,13S,14S,17S)-1-(6-imino-7H-purin-3-yl)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,4,17-triol (CAS 428506-88-1) is a chemical compound with the molecular formula C23H27N5O3 and a molecular weight of 421.5 g/mol. IUPAC name: (8R,9S,13S,14S,17S)-1-(6-imino-7H-purin-3-yl)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,4,17-triol. InChIKey: AOJSSPVGVAZWDZ-GXPADDFNSA-N.

Identity
Molecular formulaC23H27N5O3
Molecular weight421.5 g/mol
IUPAC name(8R,9S,13S,14S,17S)-1-(6-imino-7H-purin-3-yl)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,4,17-triol
InChIKeyAOJSSPVGVAZWDZ-GXPADDFNSA-N
SMILESC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C(=CC(=C4O)O)N5C=NC(=N)C6=C5N=CN6

Computed by PubChem (NCBI)