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Ibandronate-[d5] Sodium Salt

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General Information
Catalog: BLP-005876
Molecular Formula: C9H17D5NNaO7P2
Molecular Weight: 346.24

Chemical Structure

Description	Ibandronate-[d5] Sodium Salt is a labelled analogue of Ibandronate-[d5] Sodium Salt. Ibandronate Sodium Salt is an inhibitor of farnesyl diphosphate synthase.
Synonyms	(1-Hydroxy-3-(methylpentylamino)propylidene)bisphosphonic acid sodium-d5; Bondronat-d5
IUPAC Name	sodium;hydroxy-[1-hydroxy-3-[methyl(4,4,5,5,5-pentadeuteriopentyl)amino]-1-phosphonopropyl]phosphinate
Related CAS	138844-81-2 (unlabelled)
Canonical SMILES	CCCCCN(C)CCC(O)(P(=O)(O)O)P(=O)(O)[O-].[Na+]
InChI	InChI=1S/C9H23NO7P2.Na/c1-3-4-5-7-10(2)8-6-9(11,18(12,13)14)19(15,16)17;/h11H,3-8H2,1-2H3,(H2,12,13,14)(H2,15,16,17);/q;+1/p-1/i1D3,3D2;
InChI Key	LXLBEOAZMZAZND-IYSLTCQOSA-M