(3R,4R)-4-[(4aS,6aR,9R,10S,10aS)-6,6,9-trimethylspiro[1,2,3,4a,6a,7,9,10-octahydropyrano[3,2-i][2]benzofuran-8,2'-1,3-dioxolane]-10-yl]-3,4-bis(oxidanyl)butanenitrile

Systemtic Name: (3R,4R)-4-[(4aS,6aR,9R,10S,10aS)-6,6,9-trimethylspiro[1,2,3,4a,6a,7,9,10-octahydropyrano[3,2-i][2]benzofuran-8,2'-1,3-dioxolane]-10-yl]-3,4-bis(oxidanyl)butanenitrile Openeye Name: (3R,4R)-4-[(4aS,6aR,9R,10S,10aS)-6,6,9-trimethylspiro[1,2,3,4a,6a,7,9,10-octahydropyrano[3,2-i]isobenzofuran-8,2'-1,3-dioxolane]-10-yl]-3,4-dihydroxy-butanenitrile CAS Name: (3R,4R)-4-[(4aS,6aR,9R,10S,10aS)-6,6,9-trimethyl-10-spiro[1,2,3,4a,6a,7,9,10-octahydropyrano[3,2-i]isobenzofuran-8,2'-1,3-dioxolane]yl]-3,4-dihydroxybutanenitrile IUPAC Name: (3R,4R)-4-[(4aS,6aR,9R,10S,10aS)-6,6,9-trimethylspiro[1,2,3,4a,6a,7,9,10-octahydropyrano[3,2-i][2]benzofuran-8,2'-1,3-dioxolane]-10-yl]-3,4-dihydroxybutanenitrile Traditional Name: (3R,4R)-4-[(4aS,6aR,9R,10S,10aS)-6,6,9-trimethylspiro[1,2,3,4a,6a,7,9,10-octahydropyran[3,2-i]isobenzofuran-8,2'-1,3-dioxolane]-10-yl]-3,4-dihydroxy-butyronitrile Formula: C20H31NO6 MolecularWeight: 381.46324

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C23CCCOC2OC(C3CC14OCCO4)(C)C)C(C(CC#N)O)O

Isomeric SMILES

C[C@@H]1[C@@H]([C@]23CCCO[C@H]2OC([C@@H]3CC14OCCO4)(C)C)[C@H]([C@@H](CC#N)O)O

InChI

InChI=1S/C20H31NO6/c1-12-15(16(23)13(22)5-7-21)19-6-4-8-24-17(19)27-18(2,3)14(19)11-20(12)25-9-10-26-20/h12-17,22-23H,4-6,8-11H2,1-3H3/t12-,13-,14+,15-,16+,17+,19-/m1/s1