Products 441769-43-3

CAS 441769-43-3 appears in our catalog under these names: 6-Acetylacteoside, 95%, 6-O-Acetylacteoside, ROTICHROM® HPLC, 20 mg, glass. Offered by: Chemat Brand, Roth. Available pack sizes: on request, 20mg.

[(2R,3R,4R,5R,6R)-2-(acetyloxymethyl)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate (CAS 441769-43-3) is a chemical compound with the molecular formula C31H38O16 and a molecular weight of 666.6 g/mol. IUPAC name: [(2R,3R,4R,5R,6R)-2-(acetyloxymethyl)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate. InChIKey: JBGBPOYDCGQCJC-MWKLXWFVSA-N.

Identity
Molecular formulaC31H38O16
Molecular weight666.6 g/mol
IUPAC name[(2R,3R,4R,5R,6R)-2-(acetyloxymethyl)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
InChIKeyJBGBPOYDCGQCJC-MWKLXWFVSA-N
SMILESC[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](O[C@@H]([C@H]2OC(=O)/C=C/C3=CC(=C(C=C3)O)O)COC(=O)C)OCCC4=CC(=C(C=C4)O)O)O)O)O)O

Computed by PubChem (NCBI)