2-oxidanylidenepropanoic acid; phosphono dihydrogen phosphate; 7H-purine

Systemtic Name: 2-oxidanylidenepropanoic acid; phosphono dihydrogen phosphate; 7H-purine Openeye Name: 2-oxopropanoic acid; phosphono dihydrogen phosphate; 7H-purine CAS Name: 2-oxopropanoic acid; phosphono dihydrogen phosphate; 7H-purine IUPAC Name: 2-oxopropanoic acid; phosphono dihydrogen phosphate; 7H-purine Traditional Name: phosphono dihydrogen phosphate; 7H-purine; pyruvic acid Formula: C8H12N4O10P2 MolecularWeight: 386.149202

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=O)O.C1=C2C(=NC=N1)N=CN2.OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

CC(=O)C(=O)O.C1=C2C(=NC=N1)N=CN2.OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C5H4N4.C3H4O3.H4O7P2/c1-4-5(8-2-6-1)9-3-7-4;1-2(4)3(5)6;1-8(2,3)7-9(4,5)6/h1-3H,(H,6,7,8,9);1H3,(H,5,6);(H2,1,2,3)(H2,4,5,6)