Products 889359-84-6

CAS 889359-84-6 is the registry number for Atenolol beta-D-Glucuronide. Offered by: TRC. Available pack sizes: 25mg.

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

(2S,3S,4S,5R,6R)-6-[1-[4-(2-amino-2-oxoethyl)phenoxy]-3-(propan-2-ylamino)propan-2-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid (CAS 889359-84-6) is a chemical compound with the molecular formula C20H30N2O9 and a molecular weight of 442.5 g/mol. IUPAC name: (2S,3S,4S,5R,6R)-6-[1-[4-(2-amino-2-oxoethyl)phenoxy]-3-(propan-2-ylamino)propan-2-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid. InChIKey: TUFRIQODZMVHRP-RLYWBOKJSA-N.

Identity
Molecular formulaC20H30N2O9
Molecular weight442.5 g/mol
IUPAC name(2S,3S,4S,5R,6R)-6-[1-[4-(2-amino-2-oxoethyl)phenoxy]-3-(propan-2-ylamino)propan-2-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyTUFRIQODZMVHRP-RLYWBOKJSA-N
SMILESCC(C)NCC(COC1=CC=C(C=C1)CC(=O)N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O

Computed by PubChem (NCBI)