2-[2,3-bis(oxidanyl)propylamino]-5-(5-ethyl-1,3-oxazol-2-yl)-2-purin-9-yl-oxolane-3,4-diol

Systemtic Name: 2-[2,3-bis(oxidanyl)propylamino]-5-(5-ethyl-1,3-oxazol-2-yl)-2-purin-9-yl-oxolane-3,4-diol Openeye Name: 2-(2,3-dihydroxypropylamino)-5-(5-ethyloxazol-2-yl)-2-purin-9-yl-tetrahydrofuran-3,4-diol CAS Name: 2-(2,3-dihydroxypropylamino)-5-(5-ethyl-2-oxazolyl)-2-(9-purinyl)oxolane-3,4-diol IUPAC Name: 2-(2,3-dihydroxypropylamino)-5-(5-ethyl-1,3-oxazol-2-yl)-2-purin-9-yloxolane-3,4-diol Traditional Name: 5-(5-ethyloxazol-2-yl)-2-(glycerylamino)-2-purin-9-yl-tetrahydrofuran-3,4-diol Formula: C17H22N6O6 MolecularWeight: 406.39318

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(O1)C2C(C(C(O2)(NCC(CO)O)N3C=NC4=CN=CN=C43)O)O

Isomeric SMILES

CCC1=CN=C(O1)C2C(C(C(O2)(NCC(CO)O)N3C=NC4=CN=CN=C43)O)O

InChI

InChI=1S/C17H22N6O6/c1-2-10-4-19-16(28-10)13-12(26)14(27)17(29-13,22-3-9(25)6-24)23-8-21-11-5-18-7-20-15(11)23/h4-5,7-9,12-14,22,24-27H,2-3,6H2,1H3