[(1R,2S,5R,6R)-5-acetyloxy-2-oxidanyl-6-propanoyloxy-cyclohex-3-en-1-yl] propanoate

Systemtic Name: [(1R,2S,5R,6R)-5-acetyloxy-2-oxidanyl-6-propanoyloxy-cyclohex-3-en-1-yl] propanoate Openeye Name: [(1R,2S,5R,6R)-5-acetoxy-2-hydroxy-6-propanoyloxy-cyclohex-3-en-1-yl] propanoate CAS Name: propanoic acid [(1R,2S,5R,6R)-5-acetyloxy-2-hydroxy-6-(1-oxopropoxy)-1-cyclohex-3-enyl] ester IUPAC Name: [(1R,2S,5R,6R)-5-acetyloxy-2-hydroxy-6-propanoyloxycyclohex-3-en-1-yl] propanoate Traditional Name: propionic acid [(1R,2S,5R,6R)-5-acetoxy-2-hydroxy-6-propionyloxy-cyclohex-3-en-1-yl] ester Formula: C14H20O7 MolecularWeight: 300.3044

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1C(C=CC(C1OC(=O)CC)OC(=O)C)O

Isomeric SMILES

CCC(=O)O[C@@H]1[C@H](C=C[C@H]([C@H]1OC(=O)CC)OC(=O)C)O

InChI

InChI=1S/C14H20O7/c1-4-11(17)20-13-9(16)6-7-10(19-8(3)15)14(13)21-12(18)5-2/h6-7,9-10,13-14,16H,4-5H2,1-3H3/t9-,10+,13+,14+/m0/s1