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Substance Name: Nicametate citrate [JAN]
RN: 1641-74-3
UNII: 1S708RDJ0V
InChIKey: IABBAGAOMDWOCW-UHFFFAOYSA-N

Classification Codes

  • Cardiovascular Agents
  • Drug / Therapeutic Agent
  • Vasodilator Agents

Molecular Formula

  • C12-H18-N2-O2.C6-H8-O7

Molecular Weight

  • 414.408
 
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Names and Synonyms

Name of Substance

  • Nicametate
  • Nicametate citrate [JAN]

Synonyms

  • 2-Diethylaminoethyl nicotinate citrate
  • 3-Pyridinecarboxylic acid, 2-(diethylamino)ethyl ester, citrate (1:1)
  • 53 IIC
  • 53-11 C
  • EINECS 216-694-5
  • Eucast
  • Euclidan
  • Euclidan, citrate
  • Manlate
  • Nicametate citrate
  • Nicametate dihydrogen citrate
  • NSC 169477
  • Provasan
  • Soclidan
  • UNII-1S708RDJ0V

Systematic Names

  • 3-Pyridinecarboxylic acid, 2-(diethylamino)ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate (1:1) (9CI)
  • Diethyl(2-(3-pyridiniocarbonyloxy)ethyl)ammonium hydrogen citrate
  • Nicotinic acid, 2-(diethylamino)ethyl ester, citrate (1:1)

Registry Numbers

CAS Registry Number

  • 1641-74-3

FDA UNII

  • 1S708RDJ0V

System Generated Number

  • 0001641743

Molecular Formulas

Molecular Formula

  • C12-H18-N2-O2.C6-H8-O7

Molecular Formula Fragments

  • C12-H18-N2-O2
  • C6-H8-O7
  • COMPONENT

Structure Descriptors

InChI

1S/C12H18N2O2.C6H8O7/c1-3-14(4-2)8-9-16-12(15)11-6-5-7-13-10-11;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-7,10H,3-4,8-9H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

InChIKey

IABBAGAOMDWOCW-UHFFFAOYSA-N

Smiles

C(c1cnccc1)(=O)OCCN(CC)CC.C(CC(CC(=O)O)(C(=O)O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 intraperitoneal 920mg/kg (920mg/kg)   Therapie. Vol. 16, Pg. 265, 1961.
guinea pig LD50 intravenous 115mg/kg (115mg/kg)   Therapie. Vol. 16, Pg. 265, 1961.
guinea pig LD50 subcutaneous 1290mg/kg (1290mg/kg)   Therapie. Vol. 16, Pg. 265, 1961.
mouse LD50 intravenous 316mg/kg (316mg/kg)   Drugs in Japan Vol. 6, Pg. 542, 1982.
mouse LD50 oral 11900mg/kg (11900mg/kg)   Yakkyoku. Pharmacy. Vol. 24, Pg. 431, 1973.
mouse LD50 subcutaneous 2600mg/kg (2600mg/kg)   Drugs in Japan Vol. 6, Pg. 542, 1982.
rabbit LD50 intravenous 162mg/kg (162mg/kg)   Therapie. Vol. 16, Pg. 265, 1961.
rabbit LD50 subcutaneous 940mg/kg (940mg/kg)   Therapie. Vol. 16, Pg. 265, 1961.
rat LD50 intraperitoneal 1120mg/kg (1120mg/kg)   Therapie. Vol. 16, Pg. 265, 1961.
rat LD50 intravenous 327mg/kg (327mg/kg)   Drugs in Japan Vol. 6, Pg. 542, 1982.
rat LD50 oral 8400mg/kg (8400mg/kg)   Drugs in Japan Vol. 6, Pg. 542, 1982.
rat LD50 subcutaneous 1620mg/kg (1620mg/kg)   Therapie. Vol. 16, Pg. 265, 1961.