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Substance Name: Pieristoxin G
RN: 34206-60-5
InChIKey: XSEQBUVOXWTHGU-ZFSHFZNVSA-N

Note

  • From leaves of Pieris Japonica D. Don.

Molecular Formula

  • C20-H32-O8

Molecular Weight

  • 400.465
 
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Names and Synonyms

Name of Substance

  • Pieristoxin G

Synonyms

  • Bisdeacylasebotoxin VII
  • Pieristoxin G
  • PTX-G

Systematic Name

  • 7,9a-Methano-9aH-cyclopenta(b)heptalene-4,4a,8,10,11,11a,12(1H,5H)-heptol, 2,3-epoxydecahydro-1,1,4,8-tetramethyl-, (2R,3S,4ar,4S,4as,7R,8R,9ar,10S,11R,12R)-

Registry Numbers

CAS Registry Number

  • 34206-60-5

System Generated Number

  • 0034206605

Structure Descriptors

InChI

1S/C20H32O8/c1-15(2)14-9(28-14)10-17(4,25)19(26)6-5-8-11(21)18(19,7-16(8,3)24)12(22)13(23)20(10,15)27/h8-14,21-27H,5-7H2,1-4H3/t8-,9-,10-,11-,12+,13+,14-,16+,17-,18?,19+,20-/m0/s1

InChIKey

XSEQBUVOXWTHGU-ZFSHFZNVSA-N

Smiles

C1([C@@H]2[C@@H]([C@@H]3[C@@]1([C@@H]([C@H]([C@@]14[C@@H]([C@H](CC[C@@]1([C@]3(O)C)O)[C@@](O)(C4)C)O)O)O)O)O2)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 intravenous 1mg/kg (1mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES
Archives of Toxicology. Vol. 44, Pg. 259, 1980.
mouse LD50 intraperitoneal 6520ug/kg (6.52mg/kg)   Toxicology and Applied Pharmacology. Vol. 35, Pg. 303, 1976.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -0.57 (none)   EXP
Water Solubility 9330 mg/L 25 EST
Vapor Pressure 1.60E-15 mm Hg 25 EST
Henry's Law Constant 6.51E-17 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.92E-11 cm3/molecule-sec 25 EST

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