methyl (4E,8E,12E)-14-[2-acetyloxy-5-[(2S,3R,4S,5R)-3,4,5-triacetyloxyoxan-2-yl]oxy-phenyl]-4,8,12-trimethyl-tetradeca-4,8,12-trienoate

Systemtic Name: methyl (4E,8E,12E)-14-[2-acetyloxy-5-[(2S,3R,4S,5R)-3,4,5-triacetyloxyoxan-2-yl]oxy-phenyl]-4,8,12-trimethyl-tetradeca-4,8,12-trienoate Openeye Name: methyl (4E,8E,12E)-14-[2-acetoxy-5-[(2S,3R,4S,5R)-3,4,5-triacetoxytetrahydropyran-2-yl]oxy-phenyl]-4,8,12-trimethyl-tetradeca-4,8,12-trienoate CAS Name: (4E,8E,12E)-14-[2-acetyloxy-5-[[(2S,3R,4S,5R)-3,4,5-triacetyloxy-2-oxanyl]oxy]phenyl]-4,8,12-trimethyltetradeca-4,8,12-trienoic acid methyl ester IUPAC Name: methyl (4E,8E,12E)-14-[2-acetyloxy-5-[(2S,3R,4S,5R)-3,4,5-triacetyloxyoxan-2-yl]oxyphenyl]-4,8,12-trimethyltetradeca-4,8,12-trienoate Traditional Name: (4E,8E,12E)-14-[2-acetoxy-5-[(2S,3R,4S,5R)-3,4,5-triacetoxytetrahydropyran-2-yl]oxy-phenyl]-4,8,12-trimethyl-tetradeca-4,8,12-trienoic acid methyl ester Formula: C37H50O12 MolecularWeight: 686.7857

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCC1=C(C=CC(=C1)OC2C(C(C(CO2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C)CCC=C(C)CCC(=O)OC

Isomeric SMILES

C/C(=C\CC/C(=C/CC1=C(C=CC(=C1)O[C@H]2[C@@H]([C@H]([C@@H](CO2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)/C)/CC/C=C(\C)/CCC(=O)OC

InChI

InChI=1S/C37H50O12/c1-23(12-10-14-25(3)16-20-34(42)43-8)11-9-13-24(2)15-17-30-21-31(18-19-32(30)45-26(4)38)49-37-36(48-29(7)41)35(47-28(6)40)33(22-44-37)46-27(5)39/h11,14-15,18-19,21,33,35-37H,9-10,12-13,16-17,20,22H2,1-8H3/b23-11+,24-15+,25-14+/t33-,35+,36-,37+/m1/s1