Products 22688-78-4

CAS 22688-78-4 appears in our catalog under these names: Kaempferol-3-Glucuronide, Kaempferol 3–O–β–D–glucuronide, Kaempferol 3-O-β-D-glucuronide/ 99.07% (existing batch purity), Kaempferol 3-O-b-D-glucuronide, Kaempferol 3-glucuronide. Offered by: Chemat Brand, GLPBio, TargetMol, Biosynth, Chemat. Available pack sizes: on request, 1mg, 5mg, 2mg, 10mg, 25mg, 50mg, Get quote.

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

Kaempferol 3-O-glucuronide is a kaempferol O-glucuronide that is kaempferol with a beta-D-glucosiduronic acid residue attached at the 3-position. It has a role as a metabolite. It is a trihydroxyflavone and a kaempferol O-glucuronide.

Source: ChEBI

Identity
Molecular formulaC21H18O12
Molecular weight462.4 g/mol
IUPAC name(2S,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
InChIKeyFNTJVYCFNVUBOL-ZUGPOPFOSA-N
SMILESC1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O

Computed by PubChem (NCBI)