3-methyl-4-oxidanyl-4-phosphono-pentanoic acid

Systemtic Name: 3-methyl-4-oxidanyl-4-phosphono-pentanoic acid Openeye Name: 4-hydroxy-3-methyl-4-phosphono-pentanoic acid CAS Name: 4-hydroxy-3-methyl-4-phosphonopentanoic acid IUPAC Name: 4-hydroxy-3-methyl-4-phosphonopentanoic acid Traditional Name: 4-hydroxy-3-methyl-4-phosphono-valeric acid Formula: C6H13O6P MolecularWeight: 212.137581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C(C)(O)P(=O)(O)O

Isomeric SMILES

CC(CC(=O)O)C(C)(O)P(=O)(O)O

InChI

InChI=1S/C6H13O6P/c1-4(3-5(7)8)6(2,9)13(10,11)12/h4,9H,3H2,1-2H3,(H,7,8)(H2,10,11,12)