Products 198700-33-3

CAS 198700-33-3 appears in our catalog under these names: Bexarotene Acyl Glucuronide, Bexarotene Impurity 11 (Bexarotene Acyl Glucuronide), Bexarotene Acyl-beta-D-glucuronide. Offered by: Chemat Brand, Hubei YoungXin, TRC. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg.

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

(3S,6S)-3,4,5-trihydroxy-6-[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]benzoyl]oxyoxane-2-carboxylic acid (CAS 198700-33-3) is a chemical compound with the molecular formula C30H36O8 and a molecular weight of 524.6 g/mol. IUPAC name: (3S,6S)-3,4,5-trihydroxy-6-[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]benzoyl]oxyoxane-2-carboxylic acid. InChIKey: VINSDXGLDYSZBG-ZRLJOZSPSA-N.

Identity
Molecular formulaC30H36O8
Molecular weight524.6 g/mol
IUPAC name(3S,6S)-3,4,5-trihydroxy-6-[4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]benzoyl]oxyoxane-2-carboxylic acid
InChIKeyVINSDXGLDYSZBG-ZRLJOZSPSA-N
SMILESCC1=CC2=C(C=C1C(=C)C3=CC=C(C=C3)C(=O)O[C@H]4C(C([C@@H](C(O4)C(=O)O)O)O)O)C(CCC2(C)C)(C)C

Computed by PubChem (NCBI)