2-[[(2-methoxycarbonyl-4-oxidanyl-4-oxidanylidene-butyl)-oxidanyl-phosphoryl]methyl]pentanedioic acid

Systemtic Name: 2-[[(2-methoxycarbonyl-4-oxidanyl-4-oxidanylidene-butyl)-oxidanyl-phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[hydroxy-(4-hydroxy-2-methoxycarbonyl-4-oxo-butyl)phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[hydroxy-(4-hydroxy-2-methoxycarbonyl-4-oxobutyl)phosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[hydroxy-(4-hydroxy-2-methoxycarbonyl-4-oxobutyl)phosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[(2-carbomethoxy-4-hydroxy-4-keto-butyl)-hydroxy-phosphoryl]methyl]glutaric acid Formula: C12H19O10P MolecularWeight: 354.247021

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=O)O)CP(=O)(CC(CCC(=O)O)C(=O)O)O

Isomeric SMILES

COC(=O)C(CC(=O)O)CP(=O)(CC(CCC(=O)O)C(=O)O)O

InChI

InChI=1S/C12H19O10P/c1-22-12(19)8(4-10(15)16)6-23(20,21)5-7(11(17)18)2-3-9(13)14/h7-8H,2-6H2,1H3,(H,13,14)(H,15,16)(H,17,18)(H,20,21)