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Substance Name: Isochlortetracycline
RN: 514-53-4
UNII: CO2NHD53YP
InChIKey: GFSLIMZISCAANG-AXVXPIMKSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H23-Cl-N2-O8

Molecular Weight

  • 478.883
 
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Names and Synonyms

Name of Substance

  • Isochlortetracycline

Synonyms

  • 7-Chloroisotetracycline
  • Isoaureomycin
  • Isochlortetracycline
  • UNII-CO2NHD53YP

Systematic Name

  • 2-Naphthalenecarboxamide, 6-(7-chloro-1,3-dihydro-4-hydroxy-1-methyl-3-oxo-1-benzofuranyl)-4-(dimethylamino)-1,4,4a,5,6,7,8,8a-octahydro-3,8a-dihydroxy-1,8-dioxo-, (4S-(4-alpha,4a-alpha,6-beta(R*),8a-alpha))-

Registry Numbers

CAS Registry Number

  • 514-53-4

FDA UNII

  • CO2NHD53YP

System Generated Number

  • 0000514534

Structure Descriptors

InChI

1S/C22H23ClN2O8/c1-21(15-10(23)4-5-11(26)13(15)20(31)33-21)8-6-9-16(25(2)3)17(28)14(19(24)30)18(29)22(9,32)12(27)7-8/h4-5,8-9,16,26,28,32H,6-7H2,1-3H3,(H2,24,30)/t8-,9-,16-,21-,22-/m0/s1

InChIKey

GFSLIMZISCAANG-AXVXPIMKSA-N

Smiles

c1c(O)c2C(O[C@@]([C@@H]3CC(=O)[C@@]4(C(C(=C([C@H]([C@H]4C3)N(C)C)O)C(=O)N)=O)O)(c2c(c1)Cl)C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 10gm/kg (10000mg/kg)   Antibiotics Annual. Vol. 4, Pg. 843, 1956/1957.