methyl (3R,4S,5R)-3-decanoyloxy-4,5-bis(oxidanyl)cyclohexene-1-carboxylate

Systemtic Name: methyl (3R,4S,5R)-3-decanoyloxy-4,5-bis(oxidanyl)cyclohexene-1-carboxylate Openeye Name: methyl (3R,4S,5R)-3-decanoyloxy-4,5-dihydroxy-cyclohexene-1-carboxylate CAS Name: (3R,4S,5R)-4,5-dihydroxy-3-(1-oxodecoxy)-1-cyclohexenecarboxylic acid methyl ester IUPAC Name: methyl (3R,4S,5R)-3-decanoyloxy-4,5-dihydroxycyclohexene-1-carboxylate Traditional Name: (3R,4S,5R)-3-capryloxy-4,5-dihydroxy-cyclohexene-1-carboxylic acid methyl ester Formula: C18H30O6 MolecularWeight: 342.4272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OC1C=C(CC(C1O)O)C(=O)OC

Isomeric SMILES

CCCCCCCCCC(=O)O[C@@H]1C=C(C[C@H]([C@@H]1O)O)C(=O)OC

InChI

InChI=1S/C18H30O6/c1-3-4-5-6-7-8-9-10-16(20)24-15-12-13(18(22)23-2)11-14(19)17(15)21/h12,14-15,17,19,21H,3-11H2,1-2H3/t14-,15-,17+/m1/s1