Rhaponticin 2''-O-Gallate

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Catalog Number ACM94356248
Product Name Rhaponticin 2''-O-Gallate
CAS Number 94356-24-8
IUPAC Name [(2S,3R,4S,5S,6R)-4,5-dihydroxy-2-[3-hydroxy-5-[(E)-2-(3-hydroxy-4-methoxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxan-3-yl] 3,4,5-trihydroxybenzoate
Molecular Weight 572.51
Molecular Formula C28H28O13
Canonical SMILES COC1=C(C=C(C=C1)C=CC2=CC(=CC(=C2)OC3C(C(C(C(O3)CO)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)O)O
Inchi InChI=1S/C28H28O13/c1-38-21-5-4-13(8-18(21)31)2-3-14-6-16(30)11-17(7-14)39-28-26(25(36)24(35)22(12-29)40-28)41-27(37)15-9-19(32)23(34)20(33)10-15/h2-11,22,24-26,28-36H,12H2,1H3/b3-2+/t22-,24-,25+,26-,28-/m1/s1
InChIKey DBHYLGJAFYCFGS-XJVIDBJFSA-N
Purity 98%
Appearance Powder

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