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Substance Name: Tetracycline n-hexylsulfamate
RN: 16063-82-4
InChIKey: BUHARCZODRQAND-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H24-N2-O8.C6-H15-N-O3-S

Molecular Weight

  • 625.6921
 
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Names and Synonyms

Results Name

  • Tetracycline n-hexylsulfamate

Synonyms

  • Hexylsulfamic acid compd. with (4S-(4alpha,4aalpha,6beta,12aalpha))-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide (1:1)
  • N-(n-Hexyl)-sulfamate de tetracycline
  • N-(n-Hexyl)-sulfamate de tetracycline [French]
  • Tetracycline n-hexylsulfamate

Systematic Names

  • Sulfamic acid, hecyl-, compd. with 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide (1:1)
  • Sulfamic acid, hexyl-, compd. with (4S-(4alpha,4aalpha,6beta,12aalpha))-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-2-naphthacenecarboxamide (1:1)

Registry Numbers

CAS Registry Number

  • 16063-82-4

System Generated Number

  • 0016063824

Molecular Formulas

Molecular Formula

  • C22-H24-N2-O8.C6-H15-N-O3-S

Molecular Formula Fragments

  • C22-H24-N2-O8
  • C6-H15-N-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C22H24N2O8.C6H15NO3S/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28;1-2-3-4-5-6-7-11(8,9)10/h4-6,9-10,15,25,27-28,31-32H,7H2,1-3H3,(H2,23,30);7H,2-6H2,1H3,(H,8,9,10)

InChIKey

BUHARCZODRQAND-UHFFFAOYSA-N

Smiles

CCCCCCNS(=O)(=O)O.CC1(c2cccc(c2C(=O)C3=C(C4(C(CC31)C(C(=C(C4=O)C(=O)N)O)N(C)C)O)O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 738mg/kg (738mg/kg)   Chimica Therapeutica. Vol. 2, Pg. 268, 1967.