5-methyl-4-oxidanyl-4-phosphono-hexanoic acid

Systemtic Name: 5-methyl-4-oxidanyl-4-phosphono-hexanoic acid Openeye Name: 4-hydroxy-5-methyl-4-phosphono-hexanoic acid CAS Name: 4-hydroxy-5-methyl-4-phosphonohexanoic acid IUPAC Name: 4-hydroxy-5-methyl-4-phosphonohexanoic acid Traditional Name: 4-hydroxy-5-methyl-4-phosphono-hexanoic acid Formula: C7H15O6P MolecularWeight: 226.164161

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H15O6P/c1-5(2)7(10,14(11,12)13)4-3-6(8)9/h5,10H,3-4H2,1-2H3,(H,8,9)(H2,11,12,13)