[(1R,3aS,5aR,7S,9aS,9bR)-1-ethanoyl-9b-methyl-1-oxidanyl-3,3a,5a,6,7,8,9,9a-octahydrobenzo[e][2]benzofuran-7-yl]methyl ethanoate

Systemtic Name: [(1R,3aS,5aR,7S,9aS,9bR)-1-ethanoyl-9b-methyl-1-oxidanyl-3,3a,5a,6,7,8,9,9a-octahydrobenzo[e][2]benzofuran-7-yl]methyl ethanoate Openeye Name: [(1R,3aS,5aR,7S,9aS,9bR)-1-acetyl-1-hydroxy-9b-methyl-3,3a,5a,6,7,8,9,9a-octahydrobenzo[e]isobenzofuran-7-yl]methyl acetate CAS Name: acetic acid [(1R,3aS,5aR,7S,9aS,9bR)-1-acetyl-1-hydroxy-9b-methyl-3,3a,5a,6,7,8,9,9a-octahydrobenzo[e]isobenzofuran-7-yl]methyl ester IUPAC Name: [(1R,3aS,5aR,7S,9aS,9bR)-1-acetyl-1-hydroxy-9b-methyl-3,3a,5a,6,7,8,9,9a-octahydrobenzo[e][2]benzofuran-7-yl]methyl acetate Traditional Name: acetic acid [(1R,3aS,5aR,7S,9aS,9bR)-1-acetyl-1-hydroxy-9b-methyl-3,3a,5a,6,7,8,9,9a-octahydrobenz[e]isobenzofuran-7-yl]methyl ester Formula: C18H26O5 MolecularWeight: 322.39604

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(C2(C3CCC(CC3C=CC2CO1)COC(=O)C)C)O

Isomeric SMILES

CC(=O)[C@]1([C@@]2([C@H]3CC[C@@H](C[C@@H]3C=C[C@@H]2CO1)COC(=O)C)C)O

InChI

InChI=1S/C18H26O5/c1-11(19)18(21)17(3)15(10-23-18)6-5-14-8-13(4-7-16(14)17)9-22-12(2)20/h5-6,13-16,21H,4,7-10H2,1-3H3/t13-,14-,15+,16-,17-,18-/m0/s1