4,4,6,6-tetraphosphonohexanoic acid

Systemtic Name: 4,4,6,6-tetraphosphonohexanoic acid Openeye Name: 4,4,6,6-tetraphosphonohexanoic acid CAS Name: 4,4,6,6-tetraphosphonohexanoic acid IUPAC Name: 4,4,6,6-tetraphosphonohexanoic acid Traditional Name: 4,4,6,6-tetraphosphonohexanoic acid Formula: C6H16O14P4 MolecularWeight: 436.077884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H16O14P4/c7-4(8)1-2-6(23(15,16)17,24(18,19)20)3-5(21(9,10)11)22(12,13)14/h5H,1-3H2,(H,7,8)(H2,9,10,11)(H2,12,13,14)(H2,15,16,17)(H2,18,19,20)