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Name: benzylethyl 4-(7-ethoxymethyl-3-methylxanthin-1-yl)-butylphosphonate

IUPAC: 4-[7-(ethoxymethyl)-3-methyl-2,6-dioxopurin-1-yl]butyl-(3-phenylpropoxy)phosphinate

SMILES: CCOCn1cnc2c1c(=O)n(CCCCP(=O)([O-])OCCCc1ccccc1)c(=O)n2C

Canonical SMILES: CCOCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCP(=O)([O-])OCCCC3=CC=CC=C3

Summenformel: C22H30N4O6P-

Molare Masse: 477.50

InChIKey: LGMAKYQVCSJEAA-UHFFFAOYSA-M

InChI: InChI=1S/C22H31N4O6P/c1-3-31-17-25-16-23-20-19(25)21(27)26(22(28)24(20)2)13-7-8-15-33(29,30)32-14-9-12-18-10-5-4-6-11-18/h4-6,10-11,16H,3,7-9,12-15,17H2,1-2H3,(H,29,30)/p-1

PubChem CID: 86752275 →

Synonyme

LGMAKYQVCSJEAA-UHFFFAOYSA-Mbenzylethyl 4-(7-ethoxymethyl-3-methylxanthin-1-yl)-butylphosphonate

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