Dieckol

CAS Registry Number®

88095-77-6
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CAS Name

Dieckol

Molecular Formula

C36H22O18

Molecular Mass

742.55

Cite this Page

Dieckol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=88095-77-6 (retrieved 2024-03-19) (CAS RN: 88095-77-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H22O18/c37-12-1-13(38)3-15(2-12)49-31-22(44)10-25(47)34-35(31)54-30-21(43)8-17(9-27(30)52-34)48-28-19(41)6-16(7-20(28)42)50-32-23(45)11-24(46)33-36(32)53-29-18(40)4-14(39)5-26(29)51-33/h1-11,37-47H

InChIKey

InChIKey=DRZQFGYIIYNNEC-UHFFFAOYSA-N

SMILES

O(C1=C2C(OC=3C(O2)=C(O)C=C(OC4=C(O)C=C(OC5=C6C(OC=7C(O6)=C(O)C=C(O)C7)=C(O)C=C5O)C=C4O)C3)=C(O)C=C1O)C8=CC(O)=CC(O)=C8

Canonical SMILES

OC=1C=C(O)C=C(OC2=C(O)C=C(O)C=3OC4=CC(OC5=C(O)C=C(OC6=C(O)C=C(O)C=7OC=8C=C(O)C=C(O)C8OC67)C=C5O)=CC(O)=C4OC23)C1

Other Names for this Substance

  • Dibenzo[b,e][1,4]dioxin-1,3,6,8-tetrol, 4-[4-[[6-(3,5-dihydroxyphenoxy)-4,7,9-trihydroxydibenzo[b,e][1,4]dioxin-2-yl]oxy]-3,5-dihydroxyphenoxy]-
  • 4-[4-[[6-(3,5-Dihydroxyphenoxy)-4,7,9-trihydroxydibenzo[b,e][1,4]dioxin-2-yl]oxy]-3,5-dihydroxyphenoxy]dibenzo[b,e][1,4]dioxin-1,3,6,8-tetrol
  • Dieckol
  • 8,4′′′-Dieckol

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