3,3′,4′-Tri-O-methylellagic acid

CAS Registry Number®

5145-53-9
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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=5145-53-9 (retrieved 2024-05-05) (CAS RN: 5145-53-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=NDXSDWFOYZXARW-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C1OC2=C(O)C(OC)=CC=3C(=O)OC=4C(OC)=C(OC)C=C1C4C23

Other Names for this Substance

  • [1]Benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione, 3-hydroxy-2,7,8-trimethoxy-
  • 3-Hydroxy-2,7,8-trimethoxy[1]benzopyrano[5,4,3-cde][1]benzopyran-5,10-dione
  • 3,3′,4′-Tri-O-methylellagic acid
  • Nasutin B
  • 2,7,8-Trimethylellagic acid

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