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

Systemtic Name: 2-[[2-azanyl-9-[2-(phosphonomethoxy)ethyl]purin-6-yl]amino]-3-oxidanyl-propanoic acid Openeye Name: 2-[[2-amino-9-[2-(phosphonomethoxy)ethyl]purin-6-yl]amino]-3-hydroxy-propanoic acid CAS Name: 2-[[2-amino-9-[2-(phosphonomethoxy)ethyl]-6-purinyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[[2-amino-9-[2-(phosphonomethoxy)ethyl]purin-6-yl]amino]-3-hydroxypropanoic acid Traditional Name: 2-[[2-amino-9-[2-(phosphonomethoxy)ethyl]purin-6-yl]amino]-3-hydroxy-propionic acid Formula: C11H17N6O7P MolecularWeight: 376.262441

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CCOCP(=O)(O)O)N=C(N=C2NC(CO)C(=O)O)N

Isomeric SMILES

C1=NC2=C(N1CCOCP(=O)(O)O)N=C(N=C2NC(CO)C(=O)O)N

InChI

InChI=1S/C11H17N6O7P/c12-11-15-8(14-6(3-18)10(19)20)7-9(16-11)17(4-13-7)1-2-24-5-25(21,22)23/h4,6,18H,1-3,5H2,(H,19,20)(H2,21,22,23)(H3,12,14,15,16)