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Substance Name: Basinarcon
RN: 8058-01-3
InChIKey: PFMYRRLBPGUNCI-KASRZPPVSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H23-N-O3.C12-H16-N2-O3.C10-H12-N2-O4.Na

Molecular Weight

  • 771.839
 
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Names and Synonyms

  • Basinarcon

Registry Numbers

CAS Registry Number

  • 8058-01-3

System Generated Number

  • 0008058013

Molecular Formulas

Molecular Formula

  • C17-H23-N-O3.C12-H16-N2-O3.C10-H12-N2-O4.Na

Molecular Formula Fragments

  • C10-H12-N2-O4
  • C12-H16-N2-O3
  • C17-H23-N-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C17H23NO3.C12H16N2O3.C10H12N2O4.Na/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12;1-12(8-6-4-3-5-7-8)9(15)13-11(17)14(2)10(12)16;1-4-5-6(13)10(2)7(14)11-9(16)12(3)8(10)15;/h2-6,13-16,19H,7-11H2,1H3;6H,3-5,7H2,1-2H3,(H,13,15,17);4-5H,1-3H3,(H,11,14,16);/q;;;+1/p-1/b;;5-4+;/t13-,14+,15-,16?;;;

InChIKey

PFMYRRLBPGUNCI-KASRZPPVSA-M

Smiles

C1(=O)[NH-]C(=O)[C@@](C2=CCCCC2)(C(=O)N1C)C.C([C@@]1(C(N(C)C(NC1=O)=O)=O)C)(\C=C\C)=O.[Na+].OC[C@@H](C(O[C@@H]1C[C@H]2CC[C@H](C1)N2C)=O)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 425mg/kg (425mg/kg)   Acta Biologica et Medica Germanica. Vol. 6, Pg. 407, 1961.