3,3′,4-Tri-O-methylellagic acid

CAS Registry Number®

1617-49-8

CAS Name

3,3′,4-Tri-O-methylellagic acid

Molecular Formula

C17H12O8

Molecular Mass

344.27

Cite this Page

3,3′,4-Tri-O-methylellagic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1617-49-8 (retrieved 2024-11-28) (CAS RN: 1617-49-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    289-291 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C17H12O8/c1-21-9-5-7-11-10-6(16(19)25-15(11)13(9)23-3)4-8(18)12(22-2)14(10)24-17(7)20/h4-5,18H,1-3H3

InChIKey

InChIKey=LXEQIOGTMDLLEC-UHFFFAOYSA-N

SMILES

O(C)C=1C2=C3C4=C(C(OC)=C(O)C=C4C(=O)O2)OC(=O)C3=CC1OC

Canonical SMILES

O=C1OC=2C(OC)=C(OC)C=C3C(=O)OC4=C(OC)C(O)=CC1=C4C23

Other Names for this Substance

  • [1]Benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione, 2-hydroxy-3,7,8-trimethoxy-
  • Diphenic acid, 4,6,6′-trihydroxy-4′,5,5′-trimethoxy-, di-δ-lactone
  • 2-Hydroxy-3,7,8-trimethoxy[1]benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione
  • 3,3′,4-Tri-O-methylellagic acid
  • 3,4,3′-Tri-O-methylellagic acid

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Deleted or Replaced CAS Registry Numbers

124590-38-1, 729612-18-4

CAS INSIGHTSTM
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