2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-6-[2-O-[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-β-D-glucopyranosyl]-β-D-glucopyranosyl]-4H-1-benzopyran-4-one

CAS Registry Number®

220948-74-3

CAS Name

2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-6-[2-O-[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-β-D-glucopyranosyl]-β-D-glucopyranosyl]-4H-1-benzopyran-4-one

Molecular Formula

C36H36O18

Molecular Mass

756.66

Cite this Page

2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-6-[2-O-[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-β-D-glucopyranosyl]-β-D-glucopyranosyl]-4H-1-benzopyran-4-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=220948-74-3 (retrieved 2025-01-07) (CAS RN: 220948-74-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H36O18/c37-12-23-28(44)32(48)35(54-36-33(49)31(47)29(45)24(53-36)13-50-25(43)8-3-14-1-5-16(38)6-2-14)34(52-23)27-20(42)11-22-26(30(27)46)19(41)10-21(51-22)15-4-7-17(39)18(40)9-15/h1-11,23-24,28-29,31-40,42,44-49H,12-13H2/b8-3+/t23-,24-,28-,29-,31+,32+,33-,34+,35-,36+/m1/s1

InChIKey

InChIKey=MWRFISCXYNYBKS-MLUXYXKLSA-N

SMILES

OC=1C(=C(O)C=C2C1C(=O)C=C(O2)C3=CC(O)=C(O)C=C3)[C@H]4[C@H](O[C@@H]5O[C@H](COC(/C=C/C6=CC=C(O)C=C6)=O)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@@H](CO)O4

Canonical SMILES

O=C(OCC1OC(OC2C(O)C(O)C(OC2C3=C(O)C=C4OC(=CC(=O)C4=C3O)C=5C=CC(O)=C(O)C5)CO)C(O)C(O)C1O)C=CC6=CC=C(O)C=C6

Other Names for this Substance

  • 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-[2-O-[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-β-D-glucopyranosyl]-β-D-glucopyranosyl]-
  • 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-[2-O-[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-β-D-glucopyranosyl]-β-D-glucopyranosyl]-
  • 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-6-[2-O-[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-β-D-glucopyranosyl]-β-D-glucopyranosyl]-4H-1-benzopyran-4-one

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