[3-(6-aminopurin-9-yl)-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]phosphonic acid

Systemtic Name: [3-(6-aminopurin-9-yl)-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]phosphonic acid Openeye Name: [3-(6-aminopurin-9-yl)-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]phosphonic acid CAS Name: [3-(6-aminopurin-9-yl)-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]phosphonic acid IUPAC Name: [3-(6-aminopurin-9-yl)-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]phosphonic acid Traditional Name: (3-adenin-9-yl-2-methylol-3,6-dihydro-2H-pyran-6-yl)phosphonic acid Formula: C11H14N5O5P MolecularWeight: 327.233121

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(OC(C1N2C=NC3=C2N=CN=C3N)CO)P(=O)(O)O

Isomeric SMILES

C1=CC(OC(C1N2C=NC3=C2N=CN=C3N)CO)P(=O)(O)O

InChI

InChI=1S/C11H14N5O5P/c12-10-9-11(14-4-13-10)16(5-15-9)6-1-2-8(22(18,19)20)21-7(6)3-17/h1-2,4-8,17H,3H2,(H2,12,13,14)(H2,18,19,20)