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Substance Name: Adenine sulfate
RN: 321-30-2
UNII: 741GJF3K9M
InChIKey: LQXHSCOPYJCOMD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C5-H5-N5.1/2H2-O4-S

Molecular Weight

  • 368.337
 
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Names and Synonyms

Name of Substance

  • Adenine sulfate

Synonyms

  • Adenine hemisulfate
  • Adenine sulfate
  • Adenine sulfate (2:1)
  • Adeninium sulfate
  • Adeninsulfat
  • Adeninsulfat [German]
  • EINECS 206-286-5
  • UNII-741GJF3K9M

Systematic Names

  • 1H-Purin-6-amine, sulfate (2:1)
  • 9H-Purin-6-amine, sulfate (2:1)
  • Adenine, sulfate (2:1)
  • Diadenine sulphate

Registry Numbers

CAS Registry Number

  • 321-30-2

FDA UNII

  • 741GJF3K9M

Other Registry Number

  • 98537-53-2

System Generated Number

  • 0000321302

Molecular Formulas

Molecular Formula

  • C5-H5-N5.1/2H2-O4-S

Molecular Formula Fragments

  • C5-H5-N5
  • COMPONENT
  • H2-O4-S

Structure Descriptors

InChI

1S/2C5H5N5.H2O4S/c2*6-4-3-5(9-1-7-3)10-2-8-4;1-5(2,3)4/h2*1-2H,(H3,6,7,8,9,10);(H2,1,2,3,4)

InChIKey

LQXHSCOPYJCOMD-UHFFFAOYSA-N

Smiles

c12c(c([nH]cn2)N)ncn1.S(O)(O)(=O)=O.c12c(c([nH]cn2)N)ncn1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 750mg/kg (750mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: ATAXIA
Toxicology and Applied Pharmacology. Vol. 47, Pg. 229, 1979.
rat LD50 intraperitoneal 200mg/kg (200mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 232, Pg. 302, 1978.