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Tiludronic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM161642

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₇H₉ClO₆P₂S

charge

mass

317.92836

reference

InChIKey

DKJJVAGXPKPDRL-UHFFFAOYSA-N

InChI

InChI=1S/C7H9ClO6P2S/c8-5-1-3-6(4-2-5)17-7(15(9,10)11)16(12,13)14/h1-4,7H,(H2,9,10,11)(H2,12,13,14)

SMILES

O=P(O)(O)C(Sc1ccc(Cl)cc1)P(=O)(O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:9598 chebi:9598	Tiludronic acid Tiludronate tiludronate disodium
hmdb:HMDB0015265	Tiludronate (4-Chlorophenyl)thiomethylene bisphosphonic acid (Chloro-4-phenyl)thiomethylene biphosphonate (Chloro-4-phenyl)thiomethylene bisphosphonate CL2SMBP Skelid Tiludronate disodium Tiludronic acid Tiludronic acid disodium salt tiludronate {[(4-chlorophenyl)sulfanyl](phosphono)methyl}phosphonic acid
seed.compound:cpd05104 seedM:cpd05104	Tiludronate Tiludronic acid
kegg.drug:D08599 keggD:D08599	Tiludronic acid (INN)
kegg.compound:C08141 keggC:C08141	Tiludronic acid Tiludronate
hmdb:HMDB15265 keggC:M_C08141 keggD:M_D08599 seedM:M_cpd05104	secondary/obsolete/fantasy identifier