2-[3-[(3E,5E)-6-[(4Z)-6-acetyloxy-7-(1-ethoxyethoxy)-3,7-dimethyl-12-oxidanylidene-10-triethylsilyloxy-1-oxacyclododec-4-en-2-yl]-2-methyl-hepta-3,5-dienyl]oxiran-2-yl]pentan-3-yl benzoate

Systemtic Name: 2-[3-[(3E,5E)-6-[(4Z)-6-acetyloxy-7-(1-ethoxyethoxy)-3,7-dimethyl-12-oxidanylidene-10-triethylsilyloxy-1-oxacyclododec-4-en-2-yl]-2-methyl-hepta-3,5-dienyl]oxiran-2-yl]pentan-3-yl benzoate Openeye Name: [2-[3-[(3E,5E)-6-[(4Z)-6-acetoxy-7-(1-ethoxyethoxy)-3,7-dimethyl-12-oxo-10-triethylsilyloxy-1-oxacyclododec-4-en-2-yl]-2-methyl-hepta-3,5-dienyl]oxiran-2-yl]-1-ethyl-propyl] benzoate CAS Name: benzoic acid 2-[3-[(3E,5E)-6-[(4Z)-6-acetyloxy-7-(1-ethoxyethoxy)-3,7-dimethyl-12-oxo-10-triethylsilyloxy-1-oxacyclododec-4-en-2-yl]-2-methylhepta-3,5-dienyl]-2-oxiranyl]pentan-3-yl ester IUPAC Name: 2-[3-[(3E,5E)-6-[(4Z)-6-acetyloxy-7-(1-ethoxyethoxy)-3,7-dimethyl-12-oxo-10-triethylsilyloxy-1-oxacyclododec-4-en-2-yl]-2-methylhepta-3,5-dienyl]oxiran-2-yl]pentan-3-yl benzoate Traditional Name: benzoic acid [2-[3-[(3E,5E)-6-[(4Z)-6-acetoxy-7-(1-ethoxyethoxy)-12-keto-3,7-dimethyl-10-triethylsilyloxy-1-oxacyclododec-4-en-2-yl]-2-methyl-hepta-3,5-dienyl]oxiran-2-yl]-1-ethyl-propyl] ester Formula: C47H74O10Si MolecularWeight: 827.16996

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C1C(O1)CC(C)C=CC=C(C)C2C(C=CC(C(CCC(CC(=O)O2)O[Si](CC)(CC)CC)(C)OC(C)OCC)OC(=O)C)C)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CCC(C(C)C1C(O1)CC(C)/C=C/C=C(\C)/C2C(/C=C\C(C(CCC(CC(=O)O2)O[Si](CC)(CC)CC)(C)OC(C)OCC)OC(=O)C)C)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C47H74O10Si/c1-13-40(54-46(50)38-24-19-18-20-25-38)35(9)45-41(53-45)30-32(6)22-21-23-33(7)44-34(8)26-27-42(52-36(10)48)47(12,56-37(11)51-14-2)29-28-39(31-43(49)55-44)57-58(15-3,16-4)17-5/h18-27,32,34-35,37,39-42,44-45H,13-17,28-31H2,1-12H3/b22-21+,27-26-,33-23+