(1-phosphono-2-purin-9-yl-ethyl)phosphonic acid

Systemtic Name: (1-phosphono-2-purin-9-yl-ethyl)phosphonic acid Openeye Name: (1-phosphono-2-purin-9-yl-ethyl)phosphonic acid CAS Name: [1-phosphono-2-(9-purinyl)ethyl]phosphonic acid IUPAC Name: (1-phosphono-2-purin-9-ylethyl)phosphonic acid Traditional Name: (1-phosphono-2-purin-9-yl-ethyl)phosphonic acid Formula: C7H10N4O6P2 MolecularWeight: 308.125022

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC=N1)N(C=N2)CC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1=C2C(=NC=N1)N(C=N2)CC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C7H10N4O6P2/c12-18(13,14)6(19(15,16)17)2-11-4-10-5-1-8-3-9-7(5)11/h1,3-4,6H,2H2,(H2,12,13,14)(H2,15,16,17)