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Substance Name: Artemotil [INN]
RN: 75887-54-6
UNII: XGL7GFB9YI
InChIKey: NLYNIRQVMRLPIQ-XQLAAWPRSA-N

Molecular Formula

  • C17-H28-O5

Molecular Weight

  • 312.4032
 

Classification Codes

  • Amebicides
  • Anthelmintics
  • Anti-Infective Agents
  • Antimalarials
  • Antiparasitic Agents
  • Antiplatyhelmintic Agents
  • Antiprotozoal Agents
  • Drug / Therapeutic Agent
  • Schistosomicides
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Names and Synonyms

Name of Substance

  • Arteether
  • Artemotil [INN]

Synonyms

  • (3R,5aS,6R,8aS,9R,10S,12R,12aR)-10-Ethoxydecahydro-3,6,9-trimethyl-3,12-epoxy-12H-pyrano(4,3-j)-1,2-benzodioxepin
  • Arteether
  • Artemotil
  • beta-Arteether
  • beta-Dihydroartemisinin ethyl ether
  • Dihydroartemisinin ethyl ether
  • NSC 665971
  • SM 227
  • UNII-XGL7GFB9YI

Systematic Names

  • 3,12-Epoxy-12H-pyrano(4,3-j)-1,2-benzodioxepin, 10-ethoxydecahydro-3,6,9-trimethyl-, (3S-(3alpha,5alpha,6alpha,8aalpha,9beta,10beta,12beta,12aalpha))-
  • 3,12-Epoxy-12H-pyrano(4,3-j)-1,2-benzodioxepin, decahydro-10-ethoxy-3,6,9-trimethyl-, (3R-(3alpha,5abeta,6beta,8abeta,9alpha,10alpha,12beta,12aR*))-

Registry Numbers

CAS Registry Number

  • 75887-54-6

FDA UNII

  • XGL7GFB9YI

Other Registry Number

  • 159510-58-4

System Generated Number

  • 0075887546

Structure Descriptors

InChI

1S/C17H28O5/c1-5-18-14-11(3)13-7-6-10(2)12-8-9-16(4)20-15(19-14)17(12,13)22-21-16/h10-15H,5-9H2,1-4H3/t10-,11-,12+,13+,14+,15-,16-,17-/m1/s1

InChIKey

NLYNIRQVMRLPIQ-XQLAAWPRSA-N

Smiles

CCO[C@@H]1[C@@H]([C@@H]2CC[C@H]([C@H]3[C@]24[C@H](O1)OC(CC3)(OO4)C)C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.89 (none)   EXP
Water Solubility 4.950 mg/L 25 EST
Vapor Pressure 1.81E-05 mm Hg 25 EST
Henry's Law Constant 2.50E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.58E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.