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Substance Name: Blasticiden-S laurylsulfonate
RN: 63732-07-0
InChIKey: XMQMFOLSEQRNIY-NMQKUDMSSA-N

Classification Codes

  • Agricultural Chemical
  • Fungicide, Bactericide, Wood Preservative
  • Germicide, Bactericide, Disinfectant

Molecular Formula

  • C17-H26-N8-O5.C12-H26-O3-S

Molecular Weight

  • 672.8438
 
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Names and Synonyms

  • 1-Dodecanesulfonic acid, compd. with (S)-4-((3-amino-5-((aminoiminomethyl)methylamino)-1-oxopentyl)amino)-1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1,2,3,4-tetradeoxy-beta-D-erythro-hex-2-enopyranuronic acid (1:1)
  • beta-D-erythro-Hex-2-enopyranuronic acid, 4-((3-amino-5-((aminoiminomethyl)methylamino)-1-oxopentyl)amino)-1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1,2,3,4-tetradeoxy-, (S)-, mono-1-dodecanesulfonate
  • Blasticiden-S laurylsulfonate

Registry Numbers

CAS Registry Number

  • 63732-07-0

System Generated Number

  • 0063732070

Molecular Formulas

Molecular Formula

  • C17-H26-N8-O5.C12-H26-O3-S

Molecular Formula Fragments

  • C12-H26-O3-S
  • C17-H26-N8-O5
  • COMPONENT

Structure Descriptors

InChI

1S/C17H26N8O5.C12H26O3S/c1-24(16(20)21)6-4-9(18)8-12(26)22-10-2-3-13(30-14(10)15(27)28)25-7-5-11(19)23-17(25)29;1-2-3-4-5-6-7-8-9-10-11-12-16(13,14)15/h2-3,5,7,9-10,13-14H,4,6,8,18H2,1H3,(H3,20,21)(H,22,26)(H,27,28)(H2,19,23,29);2-12H2,1H3,(H,13,14,15)/t9-,10-,13+,14-;/m0./s1

InChIKey

XMQMFOLSEQRNIY-NMQKUDMSSA-N

Smiles

CCCCCCCCCCCCS(=O)(=O)O.CN(CC[C@@H](CC(=O)N[C@H]1C=C[C@@H](O[C@@H]1C(=O)O)n2ccc(nc2=O)N)N)C(=N)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 oral 32mg/kg (32mg/kg)   Guide to the Chemicals Used in Crop Protection. Vol. 6, Pg. 48, 1973.
rabbit LD50 oral 48500ug/kg (48.5mg/kg)   Guide to the Chemicals Used in Crop Protection. Vol. 6, Pg. 48, 1973.
rat LD50 oral 39500ug/kg (39.5mg/kg)   Guide to the Chemicals Used in Crop Protection. Vol. 6, Pg. 48, 1973.
rat LD50 subcutaneous 220mg/kg (220mg/kg)   Guide to the Chemicals Used in Crop Protection. Vol. 6, Pg. 48, 1973.