4-oxidanyl-5-[(1-oxidanylidene-3-phosphono-propan-2-yl)amino]-3-phosphonooxy-cyclohexene-1-carboxylic acid

Systemtic Name: 4-oxidanyl-5-[(1-oxidanylidene-3-phosphono-propan-2-yl)amino]-3-phosphonooxy-cyclohexene-1-carboxylic acid Openeye Name: 5-[(1-formyl-2-phosphono-ethyl)amino]-4-hydroxy-3-phosphonooxy-cyclohexene-1-carboxylic acid CAS Name: 4-hydroxy-5-[(1-oxo-3-phosphonopropan-2-yl)amino]-3-phosphonooxy-1-cyclohexenecarboxylic acid IUPAC Name: 4-hydroxy-5-[(1-oxo-3-phosphonopropan-2-yl)amino]-3-phosphonooxycyclohexene-1-carboxylic acid Traditional Name: 5-[(1-formyl-2-phosphono-ethyl)amino]-4-hydroxy-3-phosphonooxy-cyclohexene-1-carboxylic acid Formula: C10H17NO11P2 MolecularWeight: 389.189602

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C=C1C(=O)O)OP(=O)(O)O)O)NC(CP(=O)(O)O)C=O

Isomeric SMILES

C1C(C(C(C=C1C(=O)O)OP(=O)(O)O)O)NC(CP(=O)(O)O)C=O

InChI

InChI=1S/C10H17NO11P2/c12-3-6(4-23(16,17)18)11-7-1-5(10(14)15)2-8(9(7)13)22-24(19,20)21/h2-3,6-9,11,13H,1,4H2,(H,14,15)(H2,16,17,18)(H2,19,20,21)