MDN

METHYLENEDIPHOSPHONIC ACID

Created: 2001-01-16
Last modified:  2011-06-04

Find related ligands:

Chemical Details

Formal Charge0
Atom Count15
Chiral Atom Count0
Bond Count14
Aromatic Bond Count0
2D diagram of MDN

Chemical Component Summary

NameMETHYLENEDIPHOSPHONIC ACID
Systematic Name (OpenEye OEToolkits)phosphonomethylphosphonic acid
FormulaC H6 O6 P2
Molecular Weight176.002
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=P(O)(O)CP(=O)(O)O
SMILESCACTVS3.341O[P](O)(=O)C[P](O)(O)=O
SMILESOpenEye OEToolkits1.5.0C(P(=O)(O)O)P(=O)(O)O
Canonical SMILESCACTVS3.341 O[P](O)(=O)C[P](O)(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 C(P(=O)(O)O)P(=O)(O)O
InChIInChI1.03 InChI=1S/CH6O6P2/c2-8(3,4)1-9(5,6)7/h1H2,(H2,2,3,4)(H2,5,6,7)
InChIKeyInChI1.03 MBKDYNNUVRNNRF-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank IDDB14078 
NameMedronic acid
Groups
  • investigational
  • approved
Synonyms
  • Acido medronico
  • Methylenediphosphonic acid
  • Acidum medronicum
  • methanediylbis(phosphonic acid)
  • Acide medronique
Brand Names
  • Technetium Tc 99m Medronate
  • Mdp
CAS number1984-15-2

Related Resource References

Resource NameReference
PubChem 16124
ChEMBL CHEMBL180570
ChEBI CHEBI:43945
CCDC/CSD MEYDPA, MEYDPA11