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Substance Name: Picolinic acid, 5-butyl-, calcium salt (8CI)
RN: 21813-99-0
InChIKey: XMRLUNALKLDUPT-UHFFFAOYSA-L

Classification Codes

  • Drug / Therapeutic Agent
  • Reproductive Effect

Molecular Formulas

  • C10-H13-N-O2.1/2Ca
  • C20-H24-N2-O4.Ca.H2-O

Molecular Weight

  • 396.498
 
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Names and Synonyms

Synonyms

  • 5-Butyl-2-pyridinecarboxylic acid calcium salt hydrate
  • 5-Butylpicolinic acid calcium salt
  • 5-Butylpicolinic acid calcium salt hydrate
  • Calcium 5-butylpicolinate
  • Calcium 5-butylpicolinate hydrate
  • Calcium fusarate
  • Fusaric acid calcium salt
  • Fusaric acid,calcium salt

Systematic Names

  • 2-Pyridinecarboxylic acid, 5-butyl-, calcium salt (9CI)
  • Picolinic acid, 5-butyl-, calcium salt (8CI)
  • Picolinic acid, 5-butyl-, calcium salt, hydrate

Registry Numbers

CAS Registry Number

  • 21813-99-0

System Generated Number

  • 0021813990

Molecular Formulas

Molecular Formulas

  • C10-H13-N-O2.1/2Ca
  • C20-H24-N2-O4.Ca.H2-O

Molecular Formula Fragments

  • C10-H13-N-O2
  • C20-H24-N2-O4
  • Ca
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/2C10H13NO2.Ca/c2*1-2-3-4-8-5-6-9(10(12)13)11-7-8;/h2*5-7H,2-4H2,1H3,(H,12,13);/q;;+2/p-2

InChIKey

XMRLUNALKLDUPT-UHFFFAOYSA-L

Smiles

[Ca+2].c1(ccc(CCCC)cn1)C(=O)[O-].c1(ccc(cn1)CCCC)C(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 oral 570mg/kg (570mg/kg) GASTROINTESTINAL: NAUSEA OR VOMITING

VASCULAR: BP LOWERING NOT CHARACTERIZED IN AUTONOMIC SECTION
Japanese Journal of Antibiotics. Vol. 29, Pg. 439, 1976.
mouse LD50 intramuscular 125mg/kg (125mg/kg) VASCULAR: BP LOWERING NOT CHARACTERIZED IN AUTONOMIC SECTION Journal of Antibiotics. Vol. 22, Pg. 228, 1969.
mouse LD50 intraperitoneal 125mg/kg (125mg/kg) VASCULAR: BP LOWERING NOT CHARACTERIZED IN AUTONOMIC SECTION Journal of Antibiotics. Vol. 22, Pg. 228, 1969.
mouse LD50 oral 235mg/kg (235mg/kg) GASTROINTESTINAL: ULCERATION OR BLEEDING FROM STOMACH

VASCULAR: BP LOWERING NOT CHARACTERIZED IN AUTONOMIC SECTION

BLOOD: HEMORRHAGE
Japanese Journal of Antibiotics. Vol. 29, Pg. 439, 1976.
mouse LD50 subcutaneous 1440mg/kg (1440mg/kg) VASCULAR: BP LOWERING NOT CHARACTERIZED IN AUTONOMIC SECTION

BLOOD: HEMORRHAGE

GASTROINTESTINAL: ULCERATION OR BLEEDING FROM STOMACH
Japanese Journal of Antibiotics. Vol. 29, Pg. 439, 1976.
rabbit LD50 oral 570mg/kg (570mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

VASCULAR: BP LOWERING NOT CHARACTERIZED IN AUTONOMIC SECTION
Japanese Journal of Antibiotics. Vol. 29, Pg. 439, 1976.
rat LD50 intraperitoneal 360mg/kg (360mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION
Japanese Journal of Antibiotics. Vol. 29, Pg. 439, 1976.
rat LD50 oral 930mg/kg (930mg/kg) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Japanese Journal of Antibiotics. Vol. 29, Pg. 439, 1976.
rat LD50 subcutaneous > 1500mg/kg (1500mg/kg)   Japanese Journal of Antibiotics. Vol. 29, Pg. 439, 1976.