Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Drotaverine, acephyllinate drug combination
RN: 61954-97-0
UNII: 4AN25F4W2P
InChIKey: OUKQYSCCWVCDKU-UHFFFAOYSA-N

Note

  • Formerly called Depogen, however name is now used for another drug.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formulas

  • C24-H31-N-O4.C9-H10-N4-O4
  • C9-H10-N4-O4.C24-H31-N-O4

Molecular Weight

  • 635.714
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Drotaverine, acephyllinate drug combination

Synonyms

  • 6,7,3',4'-Tetraethoxy-1-benzal-1,2,3,4-tetrahydroisoquinoline-theophylline-7-acetate
  • Depogen
  • Drotavarine-theophylline-7-acetate
  • Drotaverine acephyllinate
  • UNII-4AN25F4W2P

Systematic Name

  • 7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, compd. with 1-((3,4-diethoxyphenyl)methyl)-6,7-diethoxy-3,4-dihydroisoquinoline (1:1)

Registry Numbers

CAS Registry Number

  • 61954-97-0

FDA UNII

  • 4AN25F4W2P

System Generated Number

  • 0061954970

Molecular Formulas

Molecular Formulas

  • C24-H31-N-O4.C9-H10-N4-O4
  • C9-H10-N4-O4.C24-H31-N-O4

Molecular Formula Fragments

  • C24-H31-N-O4
  • C9-H10-N4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C24H31NO4.C9H10N4O4/c1-5-26-21-10-9-17(14-22(21)27-6-2)13-20-19-16-24(29-8-4)23(28-7-3)15-18(19)11-12-25-20;1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h9-10,14-16H,5-8,11-13H2,1-4H3;4H,3H2,1-2H3,(H,14,15)

InChIKey

OUKQYSCCWVCDKU-UHFFFAOYSA-N

Smiles

c1(c(ccc(CC2=NCCc3cc(OCC)c(OCC)cc23)c1)OCC)OCC.c1(n(c(c2c(n1C)ncn2CC(O)=O)=O)C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 20500ug/kg (20.5mg/kg)   United States Patent Document. Vol. #4035366,
mouse LD50 oral 480mg/kg (480mg/kg)   United States Patent Document. Vol. #4035366,
rat LD50 intravenous 19500ug/kg (19.5mg/kg)   United States Patent Document. Vol. #4035366,
rat LD50 oral 540mg/kg (540mg/kg)   United States Patent Document. Vol. #4035366,