2-[[(2-methoxycarbonyl-5-oxidanyl-5-oxidanylidene-pentyl)-oxidanyl-phosphoryl]methyl]pentanedioic acid

Systemtic Name: 2-[[(2-methoxycarbonyl-5-oxidanyl-5-oxidanylidene-pentyl)-oxidanyl-phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[hydroxy-(5-hydroxy-2-methoxycarbonyl-5-oxo-pentyl)phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[hydroxy-(5-hydroxy-2-methoxycarbonyl-5-oxopentyl)phosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[hydroxy-(5-hydroxy-2-methoxycarbonyl-5-oxopentyl)phosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[(2-carbomethoxy-5-hydroxy-5-keto-pentyl)-hydroxy-phosphoryl]methyl]glutaric acid Formula: C13H21O10P MolecularWeight: 368.273601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21O10P/c1-23-13(20)9(3-5-11(16)17)7-24(21,22)6-8(12(18)19)2-4-10(14)15/h8-9H,2-7H2,1H3,(H,14,15)(H,16,17)(H,18,19)(H,21,22)