[[(Z)-5-(6-aminopurin-9-yl)pent-3-enoxy]-oxidanyl-phosphoryl] phosphono hydrogen phosphate

Systemtic Name: [[(Z)-5-(6-aminopurin-9-yl)pent-3-enoxy]-oxidanyl-phosphoryl] phosphono hydrogen phosphate Openeye Name: [[(Z)-5-(6-aminopurin-9-yl)pent-3-enoxy]-hydroxy-phosphoryl] phosphono hydrogen phosphate CAS Name: [[(Z)-5-(6-aminopurin-9-yl)pent-3-enoxy]-hydroxyphosphoryl] phosphono hydrogen phosphate IUPAC Name: [[(Z)-5-(6-aminopurin-9-yl)pent-3-enoxy]-hydroxyphosphoryl] phosphono hydrogen phosphate Traditional Name: [[(Z)-5-adenin-9-ylpent-3-enoxy]-hydroxy-phosphoryl] phosphono hydrogen phosphate Formula: C10H16N5O10P3 MolecularWeight: 459.182823

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CC=CCCOP(=O)(O)OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2C/C=C\CCOP(=O)(O)OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C10H16N5O10P3/c11-9-8-10(13-6-12-9)15(7-14-8)4-2-1-3-5-23-27(19,20)25-28(21,22)24-26(16,17)18/h1-2,6-7H,3-5H2,(H,19,20)(H,21,22)(H2,11,12,13)(H2,16,17,18)/b2-1-