β-D-Glucopyranose, cyclic 2,4-ester with 3-(6-carboxy-2,3,4-trihydroxyphenyl)tetrahydro-6-oxo-2H-pyran-2,4-dicarboxylic acid, 1-(3,4,5-trihydroxybenzoate)

CAS Registry Number®

17278-02-3

CAS Name

β-D-Glucopyranose, cyclic 2,4-ester with 3-(6-carboxy-2,3,4-trihydroxyphenyl)tetrahydro-6-oxo-2H-pyran-2,4-dicarboxylic acid, 1-(3,4,5-trihydroxybenzoate)

Molecular Formula

C27H24O19

Molecular Mass

652.47

Cite this Page

β-D-Glucopyranose, cyclic 2,4-ester with 3-(6-carboxy-2,3,4-trihydroxyphenyl)tetrahydro-6-oxo-2H-pyran-2,4-dicarboxylic acid, 1-(3,4,5-trihydroxybenzoate).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=17278-02-3 (retrieved 2024-12-18) (CAS RN: 17278-02-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H24O19/c28-5-12-20-19(36)22(27(42-12)46-24(39)6-1-9(29)16(33)10(30)2-6)45-26(41)8-4-13(32)43-21(23(37)38)15(8)14-7(25(40)44-20)3-11(31)17(34)18(14)35/h1-3,8,12,15,19-22,27-31,33-36H,4-5H2,(H,37,38)

InChIKey

InChIKey=MAKJWXCOBXWQIK-UHFFFAOYSA-N

SMILES

C(O)(=O)C1C2C=3C(C(=O)OC4C(O)C(OC(=O)C2CC(=O)O1)C(OC(=O)C5=CC(O)=C(O)C(O)=C5)OC4CO)=CC(O)=C(O)C3O

Canonical SMILES

O=C(O)C1OC(=O)CC2C(=O)OC3C(OC(=O)C4=CC(O)=C(O)C(O)=C4)OC(CO)C(OC(=O)C5=CC(O)=C(O)C(O)=C5C12)C3O

Other Names for this Substance

  • β-D-Glucopyranose, cyclic 2,4-ester with 3-(6-carboxy-2,3,4-trihydroxyphenyl)tetrahydro-6-oxo-2H-pyran-2,4-dicarboxylic acid, 1-(3,4,5-trihydroxybenzoate)
  • Glucopyranose, cyclic 2,4-ester with 3-(6-carboxy-2,3,4-trihydroxyphenyl)tetrahydro-6-oxo-2H-pyran-2,4-dicarboxylic acid 1-gallate, β-D-
  • Amlaic acid

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