Cyanidin 3-(3′′-malonylglucoside)

CAS Registry Number®

171828-61-8

CAS Name

Cyanidin 3-(3′′-malonylglucoside)

Molecular Formula

C24H23O14

Molecular Mass

535.43

Cite this Page

Cyanidin 3-(3′′-malonylglucoside).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=171828-61-8 (retrieved 2025-03-10) (CAS RN: 171828-61-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C24H22O14/c25-8-17-20(33)23(38-19(32)7-18(30)31)21(34)24(37-17)36-16-6-11-13(28)4-10(26)5-15(11)35-22(16)9-1-2-12(27)14(29)3-9/h1-6,17,20-21,23-25,33-34H,7-8H2,(H4-,26,27,28,29,30,31)/p+1/t17-,20-,21-,23+,24-/m1/s1

InChIKey

InChIKey=AWPCCUSBXWEBBS-FYFHWUFJSA-O

SMILES

O(C=1C(=[O+]C2=C(C1)C(O)=CC(O)=C2)C3=CC(O)=C(O)C=C3)[C@H]4[C@H](O)[C@@H](OC(CC(O)=O)=O)[C@H](O)[C@@H](CO)O4

Canonical SMILES

O=C(O)CC(=O)OC1C(O)C(OC2=CC=3C(O)=CC(O)=CC3[O+]=C2C=4C=CC(O)=C(O)C4)OC(CO)C1O

Other Names for this Substance

  • 1-Benzopyrylium, 3-[[3-O-(2-carboxyacetyl)-β-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-
  • 1-Benzopyrylium, 3-[[3-O-(carboxyacetyl)-β-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-
  • 3-[[3-O-(2-Carboxyacetyl)-β-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-1-benzopyrylium
  • Cyanidin 3-(3′′-malonylglucoside)
  • Cyanidin-3-O-(3′′-O-malonyl)-glucoside