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Substance Name: Mexicanine E
RN: 5945-40-4
InChIKey: GQOWVFHMXITOCQ-QWRHMFJTSA-N

Molecular Formula

  • C14-H16-O3

Molecular Weight

  • 232.277
 
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Names and Synonyms

Results Name

  • Mexicanine E

Synonyms

  • Mexicanin E
  • Mexicanine E
  • NSC 264054

Systematic Name

  • Azuleno(6,5-b)furan-2,5-dione, 3,3a,4,4a,7a,8,9,9a-octahydro-8-methyl-3-methylene-, (3aR-(3a-alpha,4a-alpha,7a-alpha,8-alpha,9a-alpha))

Registry Numbers

CAS Registry Number

  • 5945-40-4

System Generated Number

  • 0005945404

Structure Descriptors

InChI

1S/C14H16O3/c1-7-5-13-10(8(2)14(16)17-13)6-11-9(7)3-4-12(11)15/h3-4,7,9-11,13H,2,5-6H2,1H3/t7-,9+,10-,11-,13-/m1/s1

InChIKey

GQOWVFHMXITOCQ-QWRHMFJTSA-N

Smiles

C1[C@H]2[C@@H](C[C@@H](C)[C@H]3[C@@H]1C(C=C3)=O)OC(C2=C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 3080ug/kg (3.08mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

GASTROINTESTINAL: PERITONITIS

BEHAVIORAL: FOOD INTAKE (ANIMAL)
Research Communications in Chemical Pathology and Pharmacology. Vol. 28, Pg. 189, 1980.