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Substance Name: Stipitatic acid
RN: 4440-39-5
InChIKey: ANEBWDNUQVPSJT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H6-O5

Molecular Weight

  • 182.13
 
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Names and Synonyms

Results Name

  • Stipitatic acid

Synonyms

  • 3,6-Dihydroxy-5-oxo-1,3,6-cycloheptatriene-1-carboxylic acid
  • 4-10-00-03859 (Beilstein Handbook Reference)
  • BRN 2723909
  • Stipitatic acid

Systematic Name

  • 1,3,6-Cycloheptatriene-1-carboxylic acid, 3,6-dihydroxy-5-oxo-

Registry Numbers

CAS Registry Number

  • 4440-39-5

System Generated Number

  • 0004440395

Structure Descriptors

InChI

1S/C8H6O5/c9-5-1-4(8(12)13)2-6(10)7(11)3-5/h1-3,9H,(H,10,11)(H,12,13)

InChIKey

ANEBWDNUQVPSJT-UHFFFAOYSA-N

Smiles

c1(cc(c(=O)cc(c1)O)O)C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 1500mg/kg (1500mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Yakugaku Zasshi. Journal of Pharmacy. Vol. 91, Pg. 550, 1971.