[(3R,4R,5R)-5-methyl-4-(4-methylphenyl)carbonyloxy-6-oxidanyl-5-phenylmethoxy-oxan-3-yl] 4-methylbenzoate

Systemtic Name: [(3R,4R,5R)-5-methyl-4-(4-methylphenyl)carbonyloxy-6-oxidanyl-5-phenylmethoxy-oxan-3-yl] 4-methylbenzoate Openeye Name: [(3R,4R,5R)-5-benzyloxy-6-hydroxy-5-methyl-4-(4-methylbenzoyl)oxy-tetrahydropyran-3-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [(3R,4R,5R)-6-hydroxy-5-methyl-4-[(4-methylphenyl)-oxomethoxy]-5-phenylmethoxy-3-oxanyl] ester IUPAC Name: [(3R,4R,5R)-6-hydroxy-5-methyl-4-(4-methylbenzoyl)oxy-5-phenylmethoxyoxan-3-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [(3R,4R,5R)-5-benzoxy-6-hydroxy-5-methyl-4-p-toluoyloxy-tetrahydropyran-3-yl] ester Formula: C29H30O7 MolecularWeight: 490.5443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2COC(C(C2OC(=O)C3=CC=C(C=C3)C)(C)OCC4=CC=CC=C4)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)O[C@@H]2COC([C@]([C@@H]2OC(=O)C3=CC=C(C=C3)C)(C)OCC4=CC=CC=C4)O

InChI

InChI=1S/C29H30O7/c1-19-9-13-22(14-10-19)26(30)35-24-18-33-28(32)29(3,34-17-21-7-5-4-6-8-21)25(24)36-27(31)23-15-11-20(2)12-16-23/h4-16,24-25,28,32H,17-18H2,1-3H3/t24-,25-,28?,29-/m1/s1