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Topotecan Carboxylic Acid-[d6] Sodium Salt

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General Information
Catalog: BLP-007476
CAS: 1263362-92-0
Molecular Formula: C23H18D6N3NaO6
Molecular Weight: 467.48

Chemical Structure

Description	Topotecan Carboxylic Acid-[d6] Sodium Salt is a labelled novel carboxylate metabolite of Topotecan.
Synonyms	sodium (2S)-2-(1-{[bis(2H3)methylamino]methyl}-2-hydroxy-8-(hydroxymethyl)-9-oxo-9H,11H-indolizino[1,2-b]quinolin-7-yl)-2-hydroxybutanoate
IUPAC Name	sodium;(2S)-2-[1-[[bis(trideuteriomethyl)amino]methyl]-2-hydroxy-8-(hydroxymethyl)-9-oxo-11H-indolizino[1,2-b]quinolin-7-yl]-2-hydroxybutanoate
Related CAS	123949-08-6 (unlabelled)
Canonical SMILES	CCC(C1=C(C(=O)N2CC3=CC4=C(C=CC(=C4CN(C)C)O)N=C3C2=C1)CO)(C(=O)[O-])O.[Na+]
InChI	InChI=1S/C23H25N3O6.Na/c1-4-23(32,22(30)31)16-8-18-20-12(9-26(18)21(29)15(16)11-27)7-13-14(10-25(2)3)19(28)6-5-17(13)24-20;/h5-8,27-28,32H,4,9-11H2,1-3H3,(H,30,31);/q;+1/p-1/t23-;/m0./s1/i2D3,3D3;
InChI Key	MKNSEUWGSSBVQF-ZSZCRZDTSA-M
Purity	>98%