(2S,4S,5S)-2-chloranyl-6-methoxy-4,5-bis(oxidanyl)-6-oxidanylidene-hexanoic acid

Systemtic Name: (2S,4S,5S)-2-chloranyl-6-methoxy-4,5-bis(oxidanyl)-6-oxidanylidene-hexanoic acid Openeye Name: (2S,4S,5S)-2-chloro-4,5-dihydroxy-6-methoxy-6-oxo-hexanoic acid CAS Name: (2S,4S,5S)-2-chloro-4,5-dihydroxy-6-methoxy-6-oxohexanoic acid IUPAC Name: (2S,4S,5S)-2-chloro-4,5-dihydroxy-6-methoxy-6-oxohexanoic acid Traditional Name: (2S,4S,5S)-2-chloro-4,5-dihydroxy-6-keto-6-methoxy-hexanoic acid Formula: C7H11ClO6 MolecularWeight: 226.61164

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(CC(C(=O)O)Cl)O)O

Isomeric SMILES

COC(=O)[C@H]([C@H](C[C@@H](C(=O)O)Cl)O)O

InChI

InChI=1S/C7H11ClO6/c1-14-7(13)5(10)4(9)2-3(8)6(11)12/h3-5,9-10H,2H2,1H3,(H,11,12)/t3-,4-,5-/m0/s1