[(2S,3R,4S,5R,6R)-2-[[(3aS,4R,6R,7R,7aS)-6-[(4S)-hept-1-en-4-yl]oxy-2,2,4-trimethyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl]oxy]-3-[tert-butyl(dimethyl)silyl]oxy-6-[(4-methoxyphenyl)methoxymethyl]-5-oxidanyl-oxan-4-yl] (E)-2-methylbut-2-enoate

Systemtic Name: [(2S,3R,4S,5R,6R)-2-[[(3aS,4R,6R,7R,7aS)-6-[(4S)-hept-1-en-4-yl]oxy-2,2,4-trimethyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl]oxy]-3-[tert-butyl(dimethyl)silyl]oxy-6-[(4-methoxyphenyl)methoxymethyl]-5-oxidanyl-oxan-4-yl] (E)-2-methylbut-2-enoate Openeye Name: [(2S,3R,4S,5R,6R)-2-[[(3aS,4R,6R,7R,7aS)-2,2,4-trimethyl-6-[(1S)-1-propylbut-3-enoxy]-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl]oxy]-3-[tert-butyl(dimethyl)silyl]oxy-5-hydroxy-6-[(4-methoxyphenyl)methoxymethyl]tetrahydropyran-4-yl] (E)-2-methylbut-2-enoate CAS Name: (E)-2-methyl-2-butenoic acid [(2S,3R,4S,5R,6R)-2-[[(3aS,4R,6R,7R,7aS)-6-[(4S)-hept-1-en-4-yl]oxy-2,2,4-trimethyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl]oxy]-3-[tert-butyl(dimethyl)silyl]oxy-5-hydroxy-6-[(4-methoxyphenyl)methoxymethyl]-4-oxanyl] ester IUPAC Name: [(2S,3R,4S,5R,6R)-2-[[(3aS,4R,6R,7R,7aS)-6-[(4S)-hept-1-en-4-yl]oxy-2,2,4-trimethyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl]oxy]-3-[tert-butyl(dimethyl)silyl]oxy-5-hydroxy-6-[(4-methoxyphenyl)methoxymethyl]oxan-4-yl] (E)-2-methylbut-2-enoate Traditional Name: (E)-2-methylbut-2-enoic acid [(2S,3R,4S,5R,6R)-2-[[(3aS,4R,6R,7R,7aS)-2,2,4-trimethyl-6-[(1S)-1-propylbut-3-enoxy]-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-yl]oxy]-3-[tert-butyl(dimethyl)silyl]oxy-5-hydroxy-6-(p-anisyloxymethyl)tetrahydropyran-4-yl] ester Formula: C41H66O12Si MolecularWeight: 779.04104

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC=C)OC1C(C2C(C(O1)C)OC(O2)(C)C)OC3C(C(C(C(O3)COCC4=CC=C(C=C4)OC)O)OC(=O)C(=CC)C)O[Si](C)(C)C(C)(C)C

Isomeric SMILES

CCC[C@@H](CC=C)O[C@H]1[C@@H]([C@@H]2[C@H]([C@H](O1)C)OC(O2)(C)C)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COCC4=CC=C(C=C4)OC)O)OC(=O)/C(=C/C)/C)O[Si](C)(C)C(C)(C)C

InChI

InChI=1S/C41H66O12Si/c1-14-17-29(18-15-2)47-38-35(34-32(26(5)46-38)51-41(9,10)52-34)50-39-36(53-54(12,13)40(6,7)8)33(49-37(43)25(4)16-3)31(42)30(48-39)24-45-23-27-19-21-28(44-11)22-20-27/h14,16,19-22,26,29-36,38-39,42H,1,15,17-18,23-24H2,2-13H3/b25-16+/t26-,29-,30-,31-,32+,33+,34+,35-,36-,38+,39+/m1/s1