methyl (5R,6S)-2,2-dimethoxy-5,6-bis(oxidanyl)-7-oxidanylidene-8-phosphonooxy-octanoate

Systemtic Name: methyl (5R,6S)-2,2-dimethoxy-5,6-bis(oxidanyl)-7-oxidanylidene-8-phosphonooxy-octanoate Openeye Name: methyl (5R,6S)-5,6-dihydroxy-2,2-dimethoxy-7-oxo-8-phosphonooxy-octanoate CAS Name: (5R,6S)-5,6-dihydroxy-2,2-dimethoxy-7-oxo-8-phosphonooxyoctanoic acid methyl ester IUPAC Name: methyl (5R,6S)-5,6-dihydroxy-2,2-dimethoxy-7-oxo-8-phosphonooxyoctanoate Traditional Name: (5R,6S)-5,6-dihydroxy-7-keto-2,2-dimethoxy-8-phosphonooxy-caprylic acid methyl ester Formula: C11H21O11P MolecularWeight: 360.251601

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC(C(C(=O)COP(=O)(O)O)O)O)(OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C11H21O11P/c1-19-10(15)11(20-2,21-3)5-4-7(12)9(14)8(13)6-22-23(16,17)18/h7,9,12,14H,4-6H2,1-3H3,(H2,16,17,18)/t7-,9+/m1/s1