2-[(2R,3R,4R,5R,6R)-6-[(S)-[(2R,4S,5R,6R)-6-(4-chloranylbutyl)-2-methoxy-5-methyl-4-oxidanyl-oxan-2-yl]-[(4-methoxyphenyl)methoxy]methyl]-3,4-bis[(4-methoxyphenyl)methoxy]-5-methyl-oxan-2-yl]-N-methoxy-N-methyl-ethanamide

Systemtic Name: 2-[(2R,3R,4R,5R,6R)-6-[(S)-[(2R,4S,5R,6R)-6-(4-chloranylbutyl)-2-methoxy-5-methyl-4-oxidanyl-oxan-2-yl]-[(4-methoxyphenyl)methoxy]methyl]-3,4-bis[(4-methoxyphenyl)methoxy]-5-methyl-oxan-2-yl]-N-methoxy-N-methyl-ethanamide Openeye Name: 2-[(2R,3R,4R,5R,6R)-6-[(S)-[(2R,4S,5R,6R)-6-(4-chlorobutyl)-4-hydroxy-2-methoxy-5-methyl-tetrahydropyran-2-yl]-[(4-methoxyphenyl)methoxy]methyl]-3,4-bis[(4-methoxyphenyl)methoxy]-5-methyl-tetrahydropyran-2-yl]-N-methoxy-N-methyl-acetamide CAS Name: 2-[(2R,3R,4R,5R,6R)-6-[(S)-[(2R,4S,5R,6R)-6-(4-chlorobutyl)-4-hydroxy-2-methoxy-5-methyl-2-oxanyl]-[(4-methoxyphenyl)methoxy]methyl]-3,4-bis[(4-methoxyphenyl)methoxy]-5-methyl-2-oxanyl]-N-methoxy-N-methylacetamide IUPAC Name: 2-[(2R,3R,4R,5R,6R)-6-[(S)-[(2R,4S,5R,6R)-6-(4-chlorobutyl)-4-hydroxy-2-methoxy-5-methyloxan-2-yl]-[(4-methoxyphenyl)methoxy]methyl]-3,4-bis[(4-methoxyphenyl)methoxy]-5-methyloxan-2-yl]-N-methoxy-N-methylacetamide Traditional Name: 2-[(2R,3R,4R,5R,6R)-6-[(S)-[(2R,4S,5R,6R)-6-(4-chlorobutyl)-4-hydroxy-2-methoxy-5-methyl-tetrahydropyran-2-yl]-p-anisyloxy-methyl]-5-methyl-3,4-bis(p-anisyloxy)tetrahydropyran-2-yl]-N-methoxy-N-methyl-acetamide Formula: C46H64ClNO12 MolecularWeight: 858.45286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(OC1CCCCCl)(C(C2C(C(C(C(O2)CC(=O)N(C)OC)OCC3=CC=C(C=C3)OC)OCC4=CC=C(C=C4)OC)C)OCC5=CC=C(C=C5)OC)OC)O

Isomeric SMILES

C[C@@H]1[C@H](C[C@@](O[C@@H]1CCCCCl)([C@H]([C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CC(=O)N(C)OC)OCC3=CC=C(C=C3)OC)OCC4=CC=C(C=C4)OC)C)OCC5=CC=C(C=C5)OC)OC)O

InChI

InChI=1S/C46H64ClNO12/c1-30-38(49)26-46(54-7,60-39(30)11-9-10-24-47)45(58-29-34-16-22-37(53-6)23-17-34)43-31(2)42(56-27-32-12-18-35(51-4)19-13-32)44(40(59-43)25-41(50)48(3)55-8)57-28-33-14-20-36(52-5)21-15-33/h12-23,30-31,38-40,42-45,49H,9-11,24-29H2,1-8H3/t30-,31-,38+,39-,40-,42-,43-,44-,45+,46-/m1/s1