Daphneticin

CAS Registry Number®

83327-22-4
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CAS Name

Daphneticin

Molecular Formula

C20H18O8

Molecular Mass

386.35

Cite this Page

Daphneticin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=83327-22-4 (retrieved 2024-05-03) (CAS RN: 83327-22-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H18O8/c1-24-13-7-11(8-14(25-2)17(13)23)18-15(9-21)27-20-12(26-18)5-3-10-4-6-16(22)28-19(10)20/h3-8,15,18,21,23H,9H2,1-2H3/t15-,18-/m1/s1

InChIKey

InChIKey=QLFQDIADUIVNRF-CRAIPNDOSA-N

SMILES

C(O)[C@H]1OC=2C3=C(C=CC2O[C@@H]1C4=CC(OC)=C(O)C(OC)=C4)C=CC(=O)O3

Canonical SMILES

O=C1OC=2C=3OC(CO)C(OC3C=CC2C=C1)C4=CC(OC)=C(O)C(OC)=C4

Other Names for this Substance

  • 9H-Pyrano[2,3-f]-1,4-benzodioxin-9-one, 2,3-dihydro-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(hydroxymethyl)-, (2R,3R)-
  • 9H-Pyrano[2,3-f]-1,4-benzodioxin-9-one, 2,3-dihydro-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(hydroxymethyl)-, (2R-trans)-
  • (2R,3R)-2,3-Dihydro-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-(hydroxymethyl)-9H-pyrano[2,3-f]-1,4-benzodioxin-9-one
  • Daphneticin
  • 2-(4-Hydroxy-3,5-dimethoxyphenyl)-3-hydroxymethyl-2,3-dihydro-1,4,5-trioxophenanthren-6-one

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