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Substance Name: 1,3-Indandione, 2-(3,4-dimethoxy-2-hydroxyphenyl)-2-hydroxy-
RN: 75840-17-4
InChIKey: PPDNDRVXNUNXQU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H14-O6

Molecular Weight

  • 314.2916
 
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Names and Synonyms

Synonyms

  • 2-(3,4-Dimethoxy-2-hydroxyphenyl)-2-hydroxy-1,3-indandione
  • BRN 5604015

Systematic Name

  • 1,3-Indandione, 2-(3,4-dimethoxy-2-hydroxyphenyl)-2-hydroxy-

Registry Numbers

CAS Registry Number

  • 75840-17-4

System Generated Number

  • 0075840174

Structure Descriptors

InChI

1S/C17H14O6/c1-22-12-8-7-11(13(18)14(12)23-2)17(21)15(19)9-5-3-4-6-10(9)16(17)20/h3-8,18,21H,1-2H3

InChIKey

PPDNDRVXNUNXQU-UHFFFAOYSA-N

Smiles

COc1ccc(c(O)c1OC)C2(O)C(=O)c3ccccc3C2=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 255mg/kg (255mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 15, Pg. 253, 1980.