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Gatifloxacin-[d4]

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General Information
Catalog: BLP-006931
CAS: 1190043-25-4
Molecular Formula: C19H18D4FN3O4
Molecular Weight: 379.42

Chemical Structure

Description	Gatifloxacin-[d4] is an isotope labelled compound of Gatifloxacin. Gatifloxacin is a fluoroquinolone antibiotic which inhibits bacterial DNA gyrase and topoisomerase.
Synonyms	1-Cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-(3-methyl-1-piperazinyl-d4)-4-oxo-3-quinolinecarboxylic Acid; Tequin-d4; Zymar-d4
IUPAC Name	1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-7-(2,2,5,5-tetradeuterio-3-methylpiperazin-1-yl)quinoline-3-carboxylic acid
Related CAS	112811-59-3 (unlabelled)
Isomeric SMILES	[2H]C1(CN(C(C(N1)C)([2H])[2H])C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F)[2H]
Canonical SMILES	CC1CN(CCN1)C2=C(C=C3C(=C2OC)N(C=C(C3=O)C(=O)O)C4CC4)F
InChI	InChI=1S/C19H22FN3O4/c1-10-8-22(6-5-21-10)16-14(20)7-12-15(18(16)27-2)23(11-3-4-11)9-13(17(12)24)19(25)26/h7,9-11,21H,3-6,8H2,1-2H3,(H,25,26)/i5D2,8D2
InChI Key	XUBOMFCQGDBHNK-CNVQUGECSA-N
Melting Point	175-177°C
Solubility	Slightly soluble in Chloroform, Methanol
Appearance	White to Off-white Solid