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Substance Name: alpha/beta-Arteether
RN: 123492-25-1
InChIKey: SBUYPKULKMMDBZ-UTBHOMIWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H28-O5.C17-H28-O5

Molecular Weight

  • 624.8064
 
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Names and Synonyms

Name of Substance

  • alpha/beta-Arteether

Synonyms

  • 3,12-Epoxy-12H-pyrano(4,3-j)-1,2-benzodioxepin, 10-ethoxydecahydro-3,6,9-trimethyl-
  • alpha/beta-Arteether

Systematic Name

  • 3,12-Epoxy-12H-pyrano(4,3-j)-1,2-benzodioxepin, 10-ethoxydecahydro-3,6,9-trimethyl-, (3R-(3-alpha,5a-beta,6-beta,8a-beta,9-alpha,10-alpha,12-beta,12aR*))-, mixt. with (3R-(3-alpha,5a-beta,6-beta,8a-beta,9-alpha,10-beta,12-beta,12aR*))-10-ethoxydecahydro-3,6,9-trimethyl-3,12-epoxy-12H-pyrano(4,3-j)-1,2-benzodioxepin

Registry Numbers

CAS Registry Number

  • 123492-25-1

System Generated Number

  • 0123492251

Molecular Formulas

Molecular Formula

  • C17-H28-O5.C17-H28-O5

Molecular Formula Fragments

  • C17-H28-O5
  • COMPONENT

Structure Descriptors

InChI

1S/2C17H28O5/c2*1-5-18-14-11(3)13-7-6-10(2)12-8-9-16(4)20-15(19-14)17(12,13)22-21-16/h2*10-15H,5-9H2,1-4H3/t10-,11-,12+,13+,14+,15-,16+,17?;10-,11-,12+,13+,14-,15-,16+,17?/m11/s1

InChIKey

SBUYPKULKMMDBZ-UTBHOMIWSA-N

Smiles

CCO[C@@H]1[C@@H]([C@@H]2CC[C@H]([C@H]3C24[C@H](O1)O[C@](CC3)(OO4)C)C)C.CCO[C@H]1[C@@H]([C@@H]2CC[C@H]([C@H]3C24[C@H](O1)O[C@](CC3)(OO4)C)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular > 1gm/kg (1000mg/kg)   Journal of Ethnopharmacology. Vol. 27, Pg. 297, 1989.