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Substance Name: L-threo-Hexonamide, 6,6'-((1,6-dioxo-2,4-hexadiene-1,6-diyl)diimino)bis(3-amino-N-(3-amino-3-iminopropyl)-2,3,4,6-tetradeoxy-, (E,E)-, sulfate (salt), hydrate (1:2:2)
RN: 150943-99-0
InChIKey: CCYBUQTZGSMWTI-UFVDJLLLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H44-N10-O6.2H2-O4-S.2H2-O

Molecular Weight

  • 764.8312
 
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Names and Synonyms

  • L-threo-Hexonamide, 6,6'-((1,6-dioxo-2,4-hexadiene-1,6-diyl)diimino)bis(3-amino-N-(3-amino-3-iminopropyl)-2,3,4,6-tetradeoxy-, (E,E)-, sulfate (salt), hydrate (1:2:2)

Registry Numbers

CAS Registry Number

  • 150943-99-0

System Generated Number

  • 0150943990

Molecular Formulas

Molecular Formula

  • C24-H44-N10-O6.2H2-O4-S.2H2-O

Molecular Formula Fragments

  • C24-H44-N10-O6
  • COMPONENT
  • H2-O
  • H2-O4-S

Structure Descriptors

InChI

1S/C24H44N10O6.2H2O4S/c25-15(11-23(39)31-7-5-19(27)28)9-17(35)13-33-21(37)3-1-2-4-22(38)34-14-18(36)10-16(26)12-24(40)32-8-6-20(29)30;2*1-5(2,3)4/h1-4,15-18,35-36H,5-14,25-26H2,(H3,27,28)(H3,29,30)(H,31,39)(H,32,40)(H,33,37)(H,34,38);2*(H2,1,2,3,4)/b3-1+,4-2+;;

InChIKey

CCYBUQTZGSMWTI-UFVDJLLLSA-N

Smiles

C(C(=N)N)CNC(=O)CC(N)CC(O)CNC(=O)/C=C/C=C/C(=O)NCC(O)CC(N)CC(=O)NCCC(=N)N.OS(=O)(=O)O.OS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Journal of Antibiotics. Vol. 46, Pg. 803, 1993.
mouse LD50 intravenous 50mg/kg (50mg/kg)   Journal of Antibiotics. Vol. 46, Pg. 803, 1993.
mouse LD50 subcutaneous 400mg/kg (400mg/kg)   Journal of Antibiotics. Vol. 46, Pg. 803, 1993.