(3S,6R,7S,8S,12E,15S,16E)-3,7-bis[[tert-butyl(dimethyl)silyl]oxy]-4,4,6,8-tetramethyl-17-(2-methyl-1,3-thiazol-4-yl)-15-oxidanyl-5-oxidanylidene-12-[(triphenylmethyl)oxymethyl]heptadeca-12,16-dienoic acid

Systemtic Name: (3S,6R,7S,8S,12E,15S,16E)-3,7-bis[[tert-butyl(dimethyl)silyl]oxy]-4,4,6,8-tetramethyl-17-(2-methyl-1,3-thiazol-4-yl)-15-oxidanyl-5-oxidanylidene-12-[(triphenylmethyl)oxymethyl]heptadeca-12,16-dienoic acid Openeye Name: (3S,6R,7S,8S,12E,15S,16E)-3,7-bis[[tert-butyl(dimethyl)silyl]oxy]-15-hydroxy-4,4,6,8-tetramethyl-17-(2-methylthiazol-4-yl)-5-oxo-12-(trityloxymethyl)heptadeca-12,16-dienoic acid CAS Name: (3S,6R,7S,8S,12E,15S,16E)-3,7-bis[[tert-butyl(dimethyl)silyl]oxy]-15-hydroxy-4,4,6,8-tetramethyl-17-(2-methyl-4-thiazolyl)-5-oxo-12-[(triphenylmethyl)oxymethyl]heptadeca-12,16-dienoic acid IUPAC Name: (3S,6R,7S,8S,12E,15S,16E)-3,7-bis[[tert-butyl(dimethyl)silyl]oxy]-15-hydroxy-4,4,6,8-tetramethyl-17-(2-methyl-1,3-thiazol-4-yl)-5-oxo-12-(trityloxymethyl)heptadeca-12,16-dienoic acid Traditional Name: (3S,6R,7S,8S,12E,15S,16E)-3,7-bis[[tert-butyl(dimethyl)silyl]oxy]-15-hydroxy-5-keto-4,4,6,8-tetramethyl-17-(2-methylthiazol-4-yl)-12-(trityloxymethyl)heptadeca-12,16-dienoic acid Formula: C57H83NO7SSi2 MolecularWeight: 982.50742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C=CC(CC=C(CCCC(C)C(C(C)C(=O)C(C)(C)C(CC(=O)O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CC1=NC(=CS1)/C=C/[C@H](C/C=C(\CCC[C@H](C)[C@@H]([C@@H](C)C(=O)C(C)(C)[C@H](CC(=O)O)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)/COC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C57H83NO7SSi2/c1-41(52(65-68(14,15)55(7,8)9)42(2)53(62)56(10,11)50(38-51(60)61)64-67(12,13)54(4,5)6)26-25-27-44(34-36-49(59)37-35-48-40-66-43(3)58-48)39-63-57(45-28-19-16-20-29-45,46-30-21-17-22-31-46)47-32-23-18-24-33-47/h16-24,28-35,37,40-42,49-50,52,59H,25-27,36,38-39H2,1-15H3,(H,60,61)/b37-35+,44-34+/t41-,42+,49-,50-,52-/m0/s1