6-methoxy-7H-purine; [3,4,5,6-tetrakis(oxidanyl)oxan-2-yl] dihydrogen phosphate

Systemtic Name: 6-methoxy-7H-purine; [3,4,5,6-tetrakis(oxidanyl)oxan-2-yl] dihydrogen phosphate Openeye Name: 6-methoxy-7H-purine; (3,4,5,6-tetrahydroxytetrahydropyran-2-yl) dihydrogen phosphate CAS Name: 6-methoxy-7H-purine; (3,4,5,6-tetrahydroxy-2-oxanyl) dihydrogen phosphate IUPAC Name: 6-methoxy-7H-purine; (3,4,5,6-tetrahydroxyoxan-2-yl) dihydrogen phosphate Traditional Name: 6-methoxy-7H-purine; (3,4,5,6-tetrahydroxytetrahydropyran-2-yl) dihydrogen phosphate Formula: C11H17N4O10P MolecularWeight: 396.247241

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=NC2=C1NC=N2.C1(C(C(OC(C1O)OP(=O)(O)O)O)O)O

Isomeric SMILES

COC1=NC=NC2=C1NC=N2.C1(C(C(OC(C1O)OP(=O)(O)O)O)O)O

InChI

InChI=1S/C6H6N4O.C5H11O9P/c1-11-6-4-5(8-2-7-4)9-3-10-6;6-1-2(7)4(9)13-5(3(1)8)14-15(10,11)12/h2-3H,1H3,(H,7,8,9,10);1-9H,(H2,10,11,12)