Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Valeric acid, 2-(3,5-bis(methylcarbamoyl)-2,4,6-triiodophenoxy)-, compd. with 1-deoxy-1-(methylamino)-D-glucitol (1:1)
RN: 19080-48-9
InChIKey: BKSDYWNIRUWZLN-WZTVWXICSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H17-I3-N2-O5.C7-H17-N-O5

Molecular Weight

  • 881.222
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

  • Valeric acid, 2-(3,5-bis(methylcarbamoyl)-2,4,6-triiodophenoxy)-, compd. with 1-deoxy-1-(methylamino)-D-glucitol (1:1)

Registry Numbers

CAS Registry Number

  • 19080-48-9

System Generated Number

  • 0019080489

Molecular Formulas

Molecular Formula

  • C15-H17-I3-N2-O5.C7-H17-N-O5

Molecular Formula Fragments

  • C15-H17-I3-N2-O5
  • C7-H17-N-O5
  • COMPONENT

Structure Descriptors

InChI

1S/C15H17I3N2O5.C7H17NO5/c1-4-5-6(15(23)24)25-12-10(17)7(13(21)19-2)9(16)8(11(12)18)14(22)20-3;1-8-2-4(10)6(12)7(13)5(11)3-9/h6H,4-5H2,1-3H3,(H,19,21)(H,20,22)(H,23,24);4-13H,2-3H2,1H3/t;4-,5+,6+,7+/m.0/s1

InChIKey

BKSDYWNIRUWZLN-WZTVWXICSA-N

Smiles

CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.C([C@@H](CCC)Oc1c(c(c(c(c1I)C(NC)=O)I)C(NC)=O)I)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 8600mg/kg (8600mg/kg)   Pharmazie. Vol. 22, Pg. 470, 1967.