2-[2-azanyl-6-(6-azanylhexylamino)purin-9-yl]ethoxymethylphosphonic acid

Systemtic Name: 2-[2-azanyl-6-(6-azanylhexylamino)purin-9-yl]ethoxymethylphosphonic acid Openeye Name: 2-[2-amino-6-(6-aminohexylamino)purin-9-yl]ethoxymethylphosphonic acid CAS Name: 2-[2-amino-6-(6-aminohexylamino)-9-purinyl]ethoxymethylphosphonic acid IUPAC Name: 2-[2-amino-6-(6-aminohexylamino)purin-9-yl]ethoxymethylphosphonic acid Traditional Name: 2-[2-amino-6-(6-aminohexylamino)purin-9-yl]ethoxymethylphosphonic acid Formula: C14H26N7O4P MolecularWeight: 387.374501

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CCOCP(=O)(O)O)N=C(N=C2NCCCCCCN)N

Isomeric SMILES

C1=NC2=C(N1CCOCP(=O)(O)O)N=C(N=C2NCCCCCCN)N

InChI

InChI=1S/C14H26N7O4P/c15-5-3-1-2-4-6-17-12-11-13(20-14(16)19-12)21(9-18-11)7-8-25-10-26(22,23)24/h9H,1-8,10,15H2,(H2,22,23,24)(H3,16,17,19,20)