[(1E,3E,4S,6S)-4-acetyloxy-3-(acetyloxymethylidene)-11-methyl-7-methylidene-6-oxidanyl-dodeca-1,10-dien-8-ynyl] ethanoate

Systemtic Name: [(1E,3E,4S,6S)-4-acetyloxy-3-(acetyloxymethylidene)-11-methyl-7-methylidene-6-oxidanyl-dodeca-1,10-dien-8-ynyl] ethanoate Openeye Name: [(1E,3E,4S,6S)-4-acetoxy-3-(acetoxymethylene)-6-hydroxy-11-methyl-7-methylene-dodeca-1,10-dien-8-ynyl] acetate CAS Name: acetic acid [(1E,3E,4S,6S)-4-acetyloxy-3-(acetyloxymethylidene)-6-hydroxy-11-methyl-7-methylenedodeca-1,10-dien-8-ynyl] ester IUPAC Name: [(1E,3E,4S,6S)-4-acetyloxy-3-(acetyloxymethylidene)-6-hydroxy-11-methyl-7-methylidenedodeca-1,10-dien-8-ynyl] acetate Traditional Name: acetic acid [(1E,3E,4S,6S)-4-acetoxy-3-(acetoxymethylene)-6-hydroxy-11-methyl-7-methylene-dodeca-1,10-dien-8-ynyl] ester Formula: C21H26O7 MolecularWeight: 390.42694

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC#CC(=C)C(CC(C(=COC(=O)C)C=COC(=O)C)OC(=O)C)O)C

Isomeric SMILES

CC(=CC#CC(=C)[C@H](C[C@@H](/C(=C/OC(=O)C)/C=C/OC(=O)C)OC(=O)C)O)C

InChI

InChI=1S/C21H26O7/c1-14(2)8-7-9-15(3)20(25)12-21(28-18(6)24)19(13-27-17(5)23)10-11-26-16(4)22/h8,10-11,13,20-21,25H,3,12H2,1-2,4-6H3/b11-10+,19-13+/t20-,21-/m0/s1