(4S,5S,6R)-4,5,6-tris(oxidanyl)-7-oxidanylidene-8-phosphonooxy-octanoic acid

Systemtic Name: (4S,5S,6R)-4,5,6-tris(oxidanyl)-7-oxidanylidene-8-phosphonooxy-octanoic acid Openeye Name: (4S,5S,6R)-4,5,6-trihydroxy-7-oxo-8-phosphonooxy-octanoic acid CAS Name: (4S,5S,6R)-4,5,6-trihydroxy-7-oxo-8-phosphonooxyoctanoic acid IUPAC Name: (4S,5S,6R)-4,5,6-trihydroxy-7-oxo-8-phosphonooxyoctanoic acid Traditional Name: (4S,5S,6R)-4,5,6-trihydroxy-7-keto-8-phosphonooxy-caprylic acid Formula: C8H15O10P MolecularWeight: 302.172461

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)O)C(C(C(C(=O)COP(=O)(O)O)O)O)O

Isomeric SMILES

C(CC(=O)O)[C@@H]([C@@H]([C@H](C(=O)COP(=O)(O)O)O)O)O

InChI

InChI=1S/C8H15O10P/c9-4(1-2-6(11)12)7(13)8(14)5(10)3-18-19(15,16)17/h4,7-9,13-14H,1-3H2,(H,11,12)(H2,15,16,17)/t4-,7-,8-/m0/s1