[[3-(6-aminopurin-9-yl)-2-oxidanyl-propyl]amino]methylphosphonic acid

Systemtic Name: [[3-(6-aminopurin-9-yl)-2-oxidanyl-propyl]amino]methylphosphonic acid Openeye Name: [[3-(6-aminopurin-9-yl)-2-hydroxy-propyl]amino]methylphosphonic acid CAS Name: [[3-(6-aminopurin-9-yl)-2-hydroxypropyl]amino]methylphosphonic acid IUPAC Name: [[3-(6-aminopurin-9-yl)-2-hydroxypropyl]amino]methylphosphonic acid Traditional Name: [(3-adenin-9-yl-2-hydroxy-propyl)amino]methylphosphonic acid Formula: C9H15N6O4P MolecularWeight: 302.226961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CC(CNCP(=O)(O)O)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2CC(CNCP(=O)(O)O)O

InChI

InChI=1S/C9H15N6O4P/c10-8-7-9(13-3-12-8)15(4-14-7)2-6(16)1-11-5-20(17,18)19/h3-4,6,11,16H,1-2,5H2,(H2,10,12,13)(H2,17,18,19)