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(±)-Lisofylline-[d6]

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General Information
Catalog: BLP-013706
CAS: 1185995-47-4
Molecular Formula: C13H14D6N4O3
Molecular Weight: 286.36

Chemical Structure

Description	(±)-Lisofylline-[d6] is the labelled analogue of (±)-Lisofylline, which is a major oxidative metabolite of Pentoxifylline. Pentoxifylline is a potent inhibitor of phosphatidic acid generation.
Synonyms	(±)-Lisofylline-d6 (alkyl); 3,7-Dihydro-1-(5-hydroxyhexyl-d6)-3,7-dimethyl-1H-purine-2,6-dione; 1-(5-Hydroxyhexyl-d6)theobromine; (+/-)-1-(5-Hydroxyhexyl-d6)-3,7-dimethylxanthine; BL 194-d6; Pentoxifylline-d6 Alcohol
IUPAC Name	1-(4,4,5,6,6,6-hexadeuterio-5-hydroxyhexyl)-3,7-dimethylpurine-2,6-dione
Related CAS	6493-06-7 (unlabelled)
Canonical SMILES	CC(CCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C)O
InChI	InChI=1S/C13H20N4O3/c1-9(18)6-4-5-7-17-12(19)10-11(14-8-15(10)2)16(3)13(17)20/h8-9,18H,4-7H2,1-3H3/i1D3,6D2,9D
InChI Key	NSMXQKNUPPXBRG-PJFGFURISA-N
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance	White Solid
Storage	Store at 2-8°C