ethyl (3S,4R,6R)-4,6-diethyl-3-[(2S)-2-methoxy-2-phenyl-ethanoyl]oxy-6-oxidanyl-decanoate

Systemtic Name: ethyl (3S,4R,6R)-4,6-diethyl-3-[(2S)-2-methoxy-2-phenyl-ethanoyl]oxy-6-oxidanyl-decanoate Openeye Name: ethyl (3S,4R,6R)-4,6-diethyl-6-hydroxy-3-[(2S)-2-methoxy-2-phenyl-acetyl]oxy-decanoate CAS Name: (3S,4R,6R)-4,6-diethyl-6-hydroxy-3-[(2S)-2-methoxy-1-oxo-2-phenylethoxy]decanoic acid ethyl ester IUPAC Name: ethyl (3S,4R,6R)-4,6-diethyl-6-hydroxy-3-[(2S)-2-methoxy-2-phenylacetyl]oxydecanoate Traditional Name: (3S,4R,6R)-4,6-diethyl-6-hydroxy-3-[(2S)-2-methoxy-2-phenyl-acetyl]oxy-capric acid ethyl ester Formula: C25H40O6 MolecularWeight: 436.5815

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(CC(CC)C(CC(=O)OCC)OC(=O)C(C1=CC=CC=C1)OC)O

Isomeric SMILES

CCCC[C@](CC)(C[C@@H](CC)[C@H](CC(=O)OCC)OC(=O)[C@H](C1=CC=CC=C1)OC)O

InChI

InChI=1S/C25H40O6/c1-6-10-16-25(28,8-3)18-19(7-2)21(17-22(26)30-9-4)31-24(27)23(29-5)20-14-12-11-13-15-20/h11-15,19,21,23,28H,6-10,16-18H2,1-5H3/t19-,21+,23+,25-/m1/s1