[(3R,5S,7R,9S)-5,7,9-triacetyloxy-1-phenylmethoxy-undec-10-en-3-yl] ethanoate

Systemtic Name: [(3R,5S,7R,9S)-5,7,9-triacetyloxy-1-phenylmethoxy-undec-10-en-3-yl] ethanoate Openeye Name: [(1R,3S,5R,7S)-3,5,7-triacetoxy-1-(2-benzyloxyethyl)non-8-enyl] acetate CAS Name: acetic acid [(3R,5S,7R,9S)-5,7,9-triacetyloxy-1-phenylmethoxyundec-10-en-3-yl] ester IUPAC Name: [(3R,5S,7R,9S)-5,7,9-triacetyloxy-1-phenylmethoxyundec-10-en-3-yl] acetate Traditional Name: acetic acid [(1R,3S,5R,7S)-3,5,7-triacetoxy-1-(2-benzoxyethyl)non-8-enyl] ester Formula: C26H36O9 MolecularWeight: 492.55864

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCOCC1=CC=CC=C1)CC(CC(CC(C=C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)O[C@H](CCOCC1=CC=CC=C1)C[C@@H](C[C@H](C[C@@H](C=C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C26H36O9/c1-6-23(32-18(2)27)14-25(34-20(4)29)16-26(35-21(5)30)15-24(33-19(3)28)12-13-31-17-22-10-8-7-9-11-22/h6-11,23-26H,1,12-17H2,2-5H3/t23-,24-,25+,26+/m1/s1