4-oxidanylidene-4-[[9-[(2R)-2-phosphonooxypropyl]purin-6-yl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[9-[(2R)-2-phosphonooxypropyl]purin-6-yl]amino]butanoic acid Openeye Name: 4-oxo-4-[[9-[(2R)-2-phosphonooxypropyl]purin-6-yl]amino]butanoic acid CAS Name: 4-oxo-4-[[9-[(2R)-2-phosphonooxypropyl]-6-purinyl]amino]butanoic acid IUPAC Name: 4-oxo-4-[[9-[(2R)-2-phosphonooxypropyl]purin-6-yl]amino]butanoic acid Traditional Name: 4-keto-4-[[9-[(2R)-2-phosphonooxypropyl]purin-6-yl]amino]butyric acid Formula: C12H16N5O7P MolecularWeight: 373.258501

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=NC2=C1N=CN=C2NC(=O)CCC(=O)O)OP(=O)(O)O

Isomeric SMILES

C[C@H](CN1C=NC2=C1N=CN=C2NC(=O)CCC(=O)O)OP(=O)(O)O

InChI

InChI=1S/C12H16N5O7P/c1-7(24-25(21,22)23)4-17-6-15-10-11(13-5-14-12(10)17)16-8(18)2-3-9(19)20/h5-7H,2-4H2,1H3,(H,19,20)(H2,21,22,23)(H,13,14,16,18)/t7-/m1/s1