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Substance Name: Tocofibrate [INN]
RN: 50465-39-9
UNII: 2W6ATR00KI
InChIKey: VPRFDABTJNLKKR-XHZSPPMBSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C39-H59-Cl-O4

Molecular Weight

  • 627.344
 
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Names and Synonyms

Name of Substance

  • Tocofibrate
  • Tocofibrate [INN]

Synonyms

  • Tocoferol 2-(p-chlorophenoxy)-2-methylpropionate
  • Tocofibrate
  • Tocofibrato
  • Tocofibrato [INN-Spanish]
  • Tocofibrato [Spanish]
  • Tocofibratum
  • Tocofibratum [INN-Latin]
  • UNII-2W6ATR00KI

Systematic Names

  • 2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-6-chromanyl 2-(p-chlorophenoxy)-2-methylpropionate
  • Propanoic acid, 2-(4-chlorophenoxy)-2-methyl-, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl ester, (2R(4R,8R))-

Registry Numbers

CAS Registry Number

  • 50465-39-9

FDA UNII

  • 2W6ATR00KI

System Generated Number

  • 0050465399

Structure Descriptors

InChI

1S/C39H59ClO4/c1-26(2)14-11-15-27(3)16-12-17-28(4)18-13-24-39(10)25-23-34-31(7)35(29(5)30(6)36(34)44-39)42-37(41)38(8,9)43-33-21-19-32(40)20-22-33/h19-22,26-28H,11-18,23-25H2,1-10H3/t27-,28-,39-/m1/s1

InChIKey

VPRFDABTJNLKKR-XHZSPPMBSA-N

Smiles

Clc1ccc(OC(C)(C(=O)Oc2c(C)c3CC[C@@](Oc3c(C)c2C)(CCC[C@@H](CCC[C@@H](CCCC(C)C)C)C)C)C)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 10gm/kg (10000mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 16, Pg. 1, 1978.
mouse LD50 oral > 15gm/kg (15000mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 16, Pg. 1, 1978.
rabbit LD50 oral > 10gm/kg (10000mg/kg) SKIN AND APPENDAGES (SKIN): HAIR: OTHER

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)
Oyo Yakuri. Pharmacometrics. Vol. 16, Pg. 1, 1978.
rat LD50 intraperitoneal > 10gm/kg (10000mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 16, Pg. 1, 1978.
rat LD50 oral > 15gm/kg (15000mg/kg)   Oyo Yakuri. Pharmacometrics. Vol. 16, Pg. 1, 1978.