3-[[2-azanyl-9-[2-(phosphonomethoxy)ethyl]purin-6-yl]amino]propanoic acid

Systemtic Name: 3-[[2-azanyl-9-[2-(phosphonomethoxy)ethyl]purin-6-yl]amino]propanoic acid Openeye Name: 3-[[2-amino-9-[2-(phosphonomethoxy)ethyl]purin-6-yl]amino]propanoic acid CAS Name: 3-[[2-amino-9-[2-(phosphonomethoxy)ethyl]-6-purinyl]amino]propanoic acid IUPAC Name: 3-[[2-amino-9-[2-(phosphonomethoxy)ethyl]purin-6-yl]amino]propanoic acid Traditional Name: 3-[[2-amino-9-[2-(phosphonomethoxy)ethyl]purin-6-yl]amino]propionic acid Formula: C11H17N6O6P MolecularWeight: 360.263041

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CCOCP(=O)(O)O)N=C(N=C2NCCC(=O)O)N

Isomeric SMILES

C1=NC2=C(N1CCOCP(=O)(O)O)N=C(N=C2NCCC(=O)O)N

InChI

InChI=1S/C11H17N6O6P/c12-11-15-9(13-2-1-7(18)19)8-10(16-11)17(5-14-8)3-4-23-6-24(20,21)22/h5H,1-4,6H2,(H,18,19)(H2,20,21,22)(H3,12,13,15,16)