β-D-Glucopyranoside, 3,4,5-trimethoxyphenyl, 2,6-bis(3,4,5-trihydroxybenzoate)

CAS Registry Number®

125288-23-5
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CAS Name

β-D-Glucopyranoside, 3,4,5-trimethoxyphenyl, 2,6-bis(3,4,5-trihydroxybenzoate)

Molecular Formula

C29H30O17

Molecular Mass

650.54

Cite this Page

β-D-Glucopyranoside, 3,4,5-trimethoxyphenyl, 2,6-bis(3,4,5-trihydroxybenzoate).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=125288-23-5 (retrieved 2024-09-19) (CAS RN: 125288-23-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C29H30O17/c1-40-18-8-13(9-19(41-2)25(18)42-3)44-29-26(46-28(39)12-6-16(32)22(35)17(33)7-12)24(37)23(36)20(45-29)10-43-27(38)11-4-14(30)21(34)15(31)5-11/h4-9,20,23-24,26,29-37H,10H2,1-3H3/t20-,23-,24+,26-,29-/m1/s1

InChIKey

InChIKey=HGBGRHUFMIOHAP-QAJMKMLOSA-N

SMILES

O(C(=O)C1=CC(O)=C(O)C(O)=C1)[C@H]2[C@H](OC3=CC(OC)=C(OC)C(OC)=C3)O[C@H](COC(=O)C4=CC(O)=C(O)C(O)=C4)[C@@H](O)[C@@H]2O

Canonical SMILES

O=C(OCC1OC(OC=2C=C(OC)C(OC)=C(OC)C2)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C(O)C1O)C4=CC(O)=C(O)C(O)=C4

Other Names for this Substance

  • β-D-Glucopyranoside, 3,4,5-trimethoxyphenyl, 2,6-bis(3,4,5-trihydroxybenzoate)