Shanzhiside Methylester

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Catalog Number ACM64421289
CAS 64421-28-9
Structure {[CurrentData.Name]}
IUPAC Name methyl (1S,5R,7S)-5,7-dihydroxy-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate
Molecular Weight 406.4
Molecular Formula C17H26O11
Canonical SMILES CC1(CC(C2C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O)O
Inchi InChI=1S/C17H26O11/c1-17(24)3-7(19)9-6(14(23)25-2)5-26-15(10(9)17)28-16-13(22)12(21)11(20)8(4-18)27-16/h5,7-13,15-16,18-22,24H,3-4H2,1-2H3/t7-,8-,9?,10?,11-,12+,13-,15+,16+,17+/m1/s1
InChIKey KKSYAZCUYVRKML-QDXNKOLPSA-N
Purity 98%
Appearance White powder

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