[5-[6-(3-methylbut-3-enylamino)purin-9-yl]-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate

Systemtic Name: [5-[6-(3-methylbut-3-enylamino)purin-9-yl]-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [3-hydroxy-5-[6-(3-methylbut-3-enylamino)purin-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [3-hydroxy-5-[6-(3-methylbut-3-enylamino)-9-purinyl]-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [3-hydroxy-5-[6-(3-methylbut-3-enylamino)purin-9-yl]oxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [3-hydroxy-5-[6-(3-methylbut-3-enylamino)purin-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C15H22N5O6P MolecularWeight: 399.338841

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CCNC1=NC=NC2=C1N=CN2C3CC(C(O3)COP(=O)(O)O)O

Isomeric SMILES

CC(=C)CCNC1=NC=NC2=C1N=CN2C3CC(C(O3)COP(=O)(O)O)O

InChI

InChI=1S/C15H22N5O6P/c1-9(2)3-4-16-14-13-15(18-7-17-14)20(8-19-13)12-5-10(21)11(26-12)6-25-27(22,23)24/h7-8,10-12,21H,1,3-6H2,2H3,(H,16,17,18)(H2,22,23,24)