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Substance Name: Acetamide, N,N'-((2-hydroxy-1,3-propanediyl)bis(oxy-2,1-phenylene))bis(2-(butylamino)-, ethanedioate (1:2)
RN: 121033-10-1
InChIKey: YNCKDJXATRPWDB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H40-N4-O5.2C2-H2-O4

Molecular Weight

  • 680.7036
 
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Names and Synonyms

Synonym

  • N,N'-((2-Hydroxy-1,3-propanediyl)bis(oxy-2,1-phenylene))bis(2-(butylamino)acetamide)dioxalate

Systematic Name

  • Acetamide, N,N'-((2-hydroxy-1,3-propanediyl)bis(oxy-2,1-phenylene))bis(2-(butylamino)-, ethanedioate (1:2)

Registry Numbers

CAS Registry Number

  • 121033-10-1

System Generated Number

  • 0121033101

Molecular Formulas

Molecular Formula

  • C27-H40-N4-O5.2C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C27-H40-N4-O5
  • COMPONENT

Structure Descriptors

InChI

1S/C27H40N4O5.2C2H2O4/c1-3-5-15-28-17-26(33)30-22-11-7-9-13-24(22)35-19-21(32)20-36-25-14-10-8-12-23(25)31-27(34)18-29-16-6-4-2;2*3-1(4)2(5)6/h7-14,21,28-29,32H,3-6,15-20H2,1-2H3,(H,30,33)(H,31,34);2*(H,3,4)(H,5,6)

InChIKey

YNCKDJXATRPWDB-UHFFFAOYSA-N

Smiles

CCCCNCC(=O)Nc1ccccc1OCC(COc2ccccc2NC(=O)CNCCCC)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Scientia Pharmaceutica. Vol. 56, Pg. 211, 1988.