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Substance Name: 838 D
RN: 36148-80-8
UNII: Z85KL0692Y
InChIKey: VJWSKIHLIBKOBD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H10-O6-S2.C9-H21-N-O6-S2

Molecular Weight

  • 617.735
 
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Names and Synonyms

Name of Substance

  • 838 D

Synonyms

  • 838-D
  • N-Methyl-N,N-bis(3-methylsulfonyloxypropyl)amine 4,4'-biphenyldisulfonate
  • NSC 140115
  • UNII-Z85KL0692Y

Systematic Names

  • 1-Propanol, 3,3'-(methylimino)bis-, dimethanesulfonate (ester), (1,1'-biphenyl)-4,4'-disulfonate (1:1) (salt)
  • N-Methyl-bis(3-mesyloxypropyl)aminobiphenyl-4,4'-sulfonate

Registry Numbers

CAS Registry Number

  • 36148-80-8

FDA UNII

  • Z85KL0692Y

System Generated Number

  • 0036148808

Molecular Formulas

Molecular Formula

  • C12-H10-O6-S2.C9-H21-N-O6-S2

Molecular Formula Fragments

  • C12-H10-O6-S2
  • C9-H21-N-O6-S2
  • COMPONENT

Structure Descriptors

InChI

1S/C12H10O6S2.C9H21NO6S2/c13-19(14,15)11-5-1-9(2-6-11)10-3-7-12(8-4-10)20(16,17)18;1-10(6-4-8-15-17(2,11)12)7-5-9-16-18(3,13)14/h1-8H,(H,13,14,15)(H,16,17,18);4-9H2,1-3H3

InChIKey

VJWSKIHLIBKOBD-UHFFFAOYSA-N

Smiles

N(C)(CCCOS(=O)(=O)C)CCCOS(=O)(=O)C.c1(ccc(cc1)S(=O)(=O)O)c1ccc(cc1)S(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 190mg/kg (190mg/kg) GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"

SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE
Yakugaku Zasshi. Journal of Pharmacy. Vol. 93, Pg. 47, 1973.
mouse LD50 intravenous 190mg/kg (190mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"
Yakugaku Zasshi. Journal of Pharmacy. Vol. 93, Pg. 47, 1973.
mouse LD50 oral 230mg/kg (230mg/kg) GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"

SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE
Yakugaku Zasshi. Journal of Pharmacy. Vol. 93, Pg. 47, 1973.
mouse LD50 subcutaneous 205mg/kg (205mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"
Yakugaku Zasshi. Journal of Pharmacy. Vol. 93, Pg. 47, 1973.