[(4Z)-10-(1-ethoxyethoxy)-2-[(2E,4E)-6-(1-ethoxyethoxy)-7-[3-[3-(1-ethoxyethoxy)pentan-2-yl]oxiran-2-yl]-6-methyl-hepta-2,4-dien-2-yl]-3,7-dimethyl-7-oxidanyl-12-oxidanylidene-1-oxacyclododec-4-en-6-yl] ethanoate

Systemtic Name: [(4Z)-10-(1-ethoxyethoxy)-2-[(2E,4E)-6-(1-ethoxyethoxy)-7-[3-[3-(1-ethoxyethoxy)pentan-2-yl]oxiran-2-yl]-6-methyl-hepta-2,4-dien-2-yl]-3,7-dimethyl-7-oxidanyl-12-oxidanylidene-1-oxacyclododec-4-en-6-yl] ethanoate Openeye Name: [(4Z)-10-(1-ethoxyethoxy)-2-[(1E,3E)-5-(1-ethoxyethoxy)-6-[3-[2-(1-ethoxyethoxy)-1-methyl-butyl]oxiran-2-yl]-1,5-dimethyl-hexa-1,3-dienyl]-7-hydroxy-3,7-dimethyl-12-oxo-1-oxacyclododec-4-en-6-yl] acetate CAS Name: acetic acid [(4Z)-10-(1-ethoxyethoxy)-2-[(2E,4E)-6-(1-ethoxyethoxy)-7-[3-[3-(1-ethoxyethoxy)pentan-2-yl]-2-oxiranyl]-6-methylhepta-2,4-dien-2-yl]-7-hydroxy-3,7-dimethyl-12-oxo-1-oxacyclododec-4-en-6-yl] ester IUPAC Name: [(4Z)-10-(1-ethoxyethoxy)-2-[(2E,4E)-6-(1-ethoxyethoxy)-7-[3-[3-(1-ethoxyethoxy)pentan-2-yl]oxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-7-hydroxy-3,7-dimethyl-12-oxo-1-oxacyclododec-4-en-6-yl] acetate Traditional Name: acetic acid [(4Z)-10-(1-ethoxyethoxy)-2-[(1E,3E)-5-(1-ethoxyethoxy)-6-[3-[2-(1-ethoxyethoxy)-1-methyl-butyl]oxiran-2-yl]-1,5-dimethyl-hexa-1,3-dienyl]-7-hydroxy-12-keto-3,7-dimethyl-1-oxacyclododec-4-en-6-yl] ester Formula: C42H72O12 MolecularWeight: 769.01388

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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)OC(C)OCC)(C)O)OC(=O)C)C)OC(C)OCC)OC(C)OCC

Isomeric SMILES

CCC(C(C)C1C(O1)CC(C)(/C=C/C=C(\C)/C2C(/C=C\C(C(CCC(CC(=O)O2)OC(C)OCC)(C)O)OC(=O)C)C)OC(C)OCC)OC(C)OCC

InChI

InChI=1S/C42H72O12/c1-14-35(51-32(10)47-16-3)29(7)40-36(52-40)26-41(12,54-33(11)48-17-4)23-18-19-27(5)39-28(6)20-21-37(49-30(8)43)42(13,45)24-22-34(25-38(44)53-39)50-31(9)46-15-2/h18-21,23,28-29,31-37,39-40,45H,14-17,22,24-26H2,1-13H3/b21-20-,23-18+,27-19+