5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxan-3-ol; phosphoric acid

Systemtic Name: 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxan-3-ol; phosphoric acid Openeye Name: 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)tetrahydropyran-3-ol; phosphoric acid CAS Name: 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-3-oxanol; phosphoric acid IUPAC Name: 5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxan-3-ol; phosphoric acid Traditional Name: 5-adenin-9-yl-2-methylol-tetrahydropyran-3-ol; phosphoric acid Formula: C11H24N5O15P3 MolecularWeight: 559.254043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(COC(C1O)CO)N2C=NC3=C2N=CN=C3N.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O

Isomeric SMILES

C1C(COC(C1O)CO)N2C=NC3=C2N=CN=C3N.OP(=O)(O)O.OP(=O)(O)O.OP(=O)(O)O

InChI

InChI=1S/C11H15N5O3.3H3O4P/c12-10-9-11(14-4-13-10)16(5-15-9)6-1-7(18)8(2-17)19-3-6;3*1-5(2,3)4/h4-8,17-18H,1-3H2,(H2,12,13,14);3*(H3,1,2,3,4)