[(1R,2S)-2-methyl-4-methylidene-1-[(2R,3S)-3-[(2S)-pentan-2-yl]oxiran-2-yl]hept-6-enyl] (2E,4E,8S,9S,11S,12S)-8-[tert-butyl(dimethyl)silyl]oxy-9,11-bis[(4-methoxyphenyl)methoxy]-3-methyl-7,10-dimethylidene-12-oxidanyl-tetradeca-2,4,13-trienoate

Systemtic Name: [(1R,2S)-2-methyl-4-methylidene-1-[(2R,3S)-3-[(2S)-pentan-2-yl]oxiran-2-yl]hept-6-enyl] (2E,4E,8S,9S,11S,12S)-8-[tert-butyl(dimethyl)silyl]oxy-9,11-bis[(4-methoxyphenyl)methoxy]-3-methyl-7,10-dimethylidene-12-oxidanyl-tetradeca-2,4,13-trienoate Openeye Name: [(1R,2S)-2-methyl-1-[(2R,3S)-3-[(1S)-1-methylbutyl]oxiran-2-yl]-4-methylene-hept-6-enyl] (2E,4E,8S,9S,11S,12S)-8-[tert-butyl(dimethyl)silyl]oxy-12-hydroxy-9,11-bis[(4-methoxyphenyl)methoxy]-3-methyl-7,10-dimethylene-tetradeca-2,4,13-trienoate CAS Name: (2E,4E,8S,9S,11S,12S)-8-[tert-butyl(dimethyl)silyl]oxy-12-hydroxy-9,11-bis[(4-methoxyphenyl)methoxy]-3-methyl-7,10-dimethylenetetradeca-2,4,13-trienoic acid [(1R,2S)-2-methyl-4-methylene-1-[(2R,3S)-3-[(2S)-pentan-2-yl]-2-oxiranyl]hept-6-enyl] ester IUPAC Name: [(1R,2S)-2-methyl-4-methylidene-1-[(2R,3S)-3-[(2S)-pentan-2-yl]oxiran-2-yl]hept-6-enyl] (2E,4E,8S,9S,11S,12S)-8-[tert-butyl(dimethyl)silyl]oxy-12-hydroxy-9,11-bis[(4-methoxyphenyl)methoxy]-3-methyl-7,10-dimethylidenetetradeca-2,4,13-trienoate Traditional Name: (2E,4E,8S,9S,11S,12S)-8-[tert-butyl(dimethyl)silyl]oxy-12-hydroxy-3-methyl-7,10-dimethylene-9,11-bis(p-anisyloxy)tetradeca-2,4,13-trienoic acid [(1R,2S)-2-methyl-1-[(2R,3S)-3-[(1S)-1-methylbutyl]oxiran-2-yl]-4-methylene-hept-6-enyl] ester Formula: C55H80O9Si MolecularWeight: 913.3038

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1C(O1)C(C(C)CC(=C)CC=C)OC(=O)C=C(C)C=CCC(=C)C(C(C(=C)C(C(C=C)O)OCC2=CC=C(C=C2)OC)OCC3=CC=C(C=C3)OC)O[Si](C)(C)C(C)(C)C

Isomeric SMILES

CCC[C@H](C)[C@H]1[C@@H](O1)[C@@H]([C@@H](C)CC(=C)CC=C)OC(=O)/C=C(\C)/C=C/CC(=C)[C@@H]([C@H](C(=C)[C@@H]([C@H](C=C)O)OCC2=CC=C(C=C2)OC)OCC3=CC=C(C=C3)OC)O[Si](C)(C)C(C)(C)C

InChI

InChI=1S/C55H80O9Si/c1-17-21-37(4)33-41(8)50(54-49(63-54)39(6)22-18-2)62-48(57)34-38(5)23-20-24-40(7)51(64-65(15,16)55(10,11)12)53(61-36-44-27-31-46(59-14)32-28-44)42(9)52(47(56)19-3)60-35-43-25-29-45(58-13)30-26-43/h17,19-20,23,25-32,34,39,41,47,49-54,56H,1,3-4,7,9,18,21-22,24,33,35-36H2,2,5-6,8,10-16H3/b23-20+,38-34+/t39-,41-,47-,49-,50+,51-,52-,53-,54+/m0/s1