(3S,4R,5S)-5-methyl-3-oxidanyl-4-(2,2,7-trimethyl-1,3-benzodioxol-4-yl)oxan-2-one

Systemtic Name: (3S,4R,5S)-5-methyl-3-oxidanyl-4-(2,2,7-trimethyl-1,3-benzodioxol-4-yl)oxan-2-one Openeye Name: (3S,4R,5S)-3-hydroxy-5-methyl-4-(2,2,7-trimethyl-1,3-benzodioxol-4-yl)tetrahydropyran-2-one CAS Name: (3S,4R,5S)-3-hydroxy-5-methyl-4-(2,2,7-trimethyl-1,3-benzodioxol-4-yl)-2-oxanone IUPAC Name: (3S,4R,5S)-3-hydroxy-5-methyl-4-(2,2,7-trimethyl-1,3-benzodioxol-4-yl)oxan-2-one Traditional Name: (3S,4R,5S)-3-hydroxy-5-methyl-4-(2,2,7-trimethyl-1,3-benzodioxol-4-yl)tetrahydropyran-2-one Formula: C16H20O5 MolecularWeight: 292.327

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Descriptors Computed from Structure

Canonical SMILES:

CC1COC(=O)C(C1C2=C3C(=C(C=C2)C)OC(O3)(C)C)O

Isomeric SMILES

C[C@@H]1COC(=O)[C@H]([C@H]1C2=C3C(=C(C=C2)C)OC(O3)(C)C)O

InChI

InChI=1S/C16H20O5/c1-8-5-6-10(14-13(8)20-16(3,4)21-14)11-9(2)7-19-15(18)12(11)17/h5-6,9,11-12,17H,7H2,1-4H3/t9-,11-,12+/m1/s1