[(1E,3Z)-5-[2,6,8-tris(oxidanylidene)-9-[(2R,3S,4R)-2,3,4,5-tetrakis(oxidanyl)pentyl]-3H-purin-7-yl]penta-1,3-dienyl] dihydrogen phosphate

Systemtic Name: [(1E,3Z)-5-[2,6,8-tris(oxidanylidene)-9-[(2R,3S,4R)-2,3,4,5-tetrakis(oxidanyl)pentyl]-3H-purin-7-yl]penta-1,3-dienyl] dihydrogen phosphate Openeye Name: [(1E,3Z)-5-[2,6,8-trioxo-9-[(2R,3S,4R)-2,3,4,5-tetrahydroxypentyl]-3H-purin-7-yl]penta-1,3-dienyl] dihydrogen phosphate CAS Name: [(1E,3Z)-5-[2,6,8-trioxo-9-[(2R,3S,4R)-2,3,4,5-tetrahydroxypentyl]-3H-purin-7-yl]penta-1,3-dienyl] dihydrogen phosphate IUPAC Name: [(1E,3Z)-5-[2,6,8-trioxo-9-[(2R,3S,4R)-2,3,4,5-tetrahydroxypentyl]-3H-purin-7-yl]penta-1,3-dienyl] dihydrogen phosphate Traditional Name: [(1E,3Z)-5-[2,6,8-triketo-9-[(2R,3S,4R)-2,3,4,5-tetrahydroxypentyl]-3H-purin-7-yl]penta-1,3-dienyl] dihydrogen phosphate Formula: C15H21N4O11P MolecularWeight: 464.321201

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Descriptors Computed from Structure

Canonical SMILES:

C(C=CC=COP(=O)(O)O)N1C2=C(NC(=O)NC2=O)N(C1=O)CC(C(C(CO)O)O)O

Isomeric SMILES

C(/C=C\C=C\OP(=O)(O)O)N1C2=C(NC(=O)NC2=O)N(C1=O)C[C@H]([C@@H]([C@@H](CO)O)O)O

InChI

InChI=1S/C15H21N4O11P/c20-7-9(22)11(23)8(21)6-19-12-10(13(24)17-14(25)16-12)18(15(19)26)4-2-1-3-5-30-31(27,28)29/h1-3,5,8-9,11,20-23H,4,6-7H2,(H2,27,28,29)(H2,16,17,24,25)/b2-1-,5-3+/t8-,9-,11+/m1/s1