[5-(2-azanyl-6-methoxy-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl pentanoate

Systemtic Name: [5-(2-azanyl-6-methoxy-purin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl pentanoate Openeye Name: [5-(2-amino-6-methoxy-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl pentanoate CAS Name: pentanoic acid [5-(2-amino-6-methoxy-9-purinyl)-3,4-dihydroxy-2-oxolanyl]methyl ester IUPAC Name: [5-(2-amino-6-methoxypurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl pentanoate Traditional Name: valeric acid [5-(2-amino-6-methoxy-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C16H23N5O6 MolecularWeight: 381.38372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=C(N=C3OC)N)O)O

Isomeric SMILES

CCCCC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=C(N=C3OC)N)O)O

InChI

InChI=1S/C16H23N5O6/c1-3-4-5-9(22)26-6-8-11(23)12(24)15(27-8)21-7-18-10-13(21)19-16(17)20-14(10)25-2/h7-8,11-12,15,23-24H,3-6H2,1-2H3,(H2,17,19,20)