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Substance Name: 2(3H)-Furanone, 4,5-dihydro-4-acetyl-5-(2,4,5-trimethoxyphenyl)-, (E)-
RN: 88221-00-5
InChIKey: GUJUVEHFTFNMRH-PSLIRLAXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H18-O6

Molecular Weight

  • 294.3012
 
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Names and Synonyms

Synonyms

  • BRN 4521804
  • trans-4-Acetyl-5-(2,4,5-trimethoxyphenyl)-4,5-dihydro-2(3H)-furanone

Systematic Name

  • 2(3H)-Furanone, 4,5-dihydro-4-acetyl-5-(2,4,5-trimethoxyphenyl)-, (E)-

Registry Numbers

CAS Registry Number

  • 88221-00-5

System Generated Number

  • 0088221005

Structure Descriptors

InChI

1S/C15H18O6/c1-8(16)9-6-14(17)21-15(9)10-5-12(19-3)13(20-4)7-11(10)18-2/h5,7,9,15H,6H2,1-4H3/t9-,15+/m1/s1

InChIKey

GUJUVEHFTFNMRH-PSLIRLAXSA-N

Smiles

CC(=O)[C@H]1CC(=O)O[C@@H]1c2cc(c(cc2OC)OC)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1500mg/kg (1500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 18, Pg. 301, 1983.