[4-methyl-4,5-bis(oxidanyl)-1-phosphono-pentyl]phosphonic acid

Systemtic Name: [4-methyl-4,5-bis(oxidanyl)-1-phosphono-pentyl]phosphonic acid Openeye Name: (4,5-dihydroxy-4-methyl-1-phosphono-pentyl)phosphonic acid CAS Name: (4,5-dihydroxy-4-methyl-1-phosphonopentyl)phosphonic acid IUPAC Name: (4,5-dihydroxy-4-methyl-1-phosphonopentyl)phosphonic acid Traditional Name: (4,5-dihydroxy-4-methyl-1-phosphono-pentyl)phosphonic acid Formula: C6H16O8P2 MolecularWeight: 278.133962

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(P(=O)(O)O)P(=O)(O)O)(CO)O

Isomeric SMILES

CC(CCC(P(=O)(O)O)P(=O)(O)O)(CO)O

InChI

InChI=1S/C6H16O8P2/c1-6(8,4-7)3-2-5(15(9,10)11)16(12,13)14/h5,7-8H,2-4H2,1H3,(H2,9,10,11)(H2,12,13,14)