4-[[2,2-dimethyl-1,3-bis(oxidanyl)propyl]-oxidanyl-phosphoryl]butanoic acid

Systemtic Name: 4-[[2,2-dimethyl-1,3-bis(oxidanyl)propyl]-oxidanyl-phosphoryl]butanoic acid Openeye Name: 4-[(1,3-dihydroxy-2,2-dimethyl-propyl)-hydroxy-phosphoryl]butanoic acid CAS Name: 4-[(1,3-dihydroxy-2,2-dimethylpropyl)-hydroxyphosphoryl]butanoic acid IUPAC Name: 4-[(1,3-dihydroxy-2,2-dimethylpropyl)-hydroxyphosphoryl]butanoic acid Traditional Name: 4-[(1,3-dihydroxy-2,2-dimethyl-propyl)-hydroxy-phosphoryl]butyric acid Formula: C9H19O6P MolecularWeight: 254.217321

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)C(O)P(=O)(CCCC(=O)O)O

Isomeric SMILES

CC(C)(CO)C(O)P(=O)(CCCC(=O)O)O

InChI

InChI=1S/C9H19O6P/c1-9(2,6-10)8(13)16(14,15)5-3-4-7(11)12/h8,10,13H,3-6H2,1-2H3,(H,11,12)(H,14,15)