[(1S,4R,4aS,5S,8aR)-6-methoxy-4,7,8a-trimethyl-5-(oxan-2-yloxy)-8-oxidanylidene-1,2,3,4,4a,5-hexahydronaphthalen-1-yl] propanoate

Systemtic Name: [(1S,4R,4aS,5S,8aR)-6-methoxy-4,7,8a-trimethyl-5-(oxan-2-yloxy)-8-oxidanylidene-1,2,3,4,4a,5-hexahydronaphthalen-1-yl] propanoate Openeye Name: [(1S,4R,4aS,5S,8aR)-6-methoxy-4,7,8a-trimethyl-8-oxo-5-tetrahydropyran-2-yloxy-1,2,3,4,4a,5-hexahydronaphthalen-1-yl] propanoate CAS Name: propanoic acid [(1S,4R,4aS,5S,8aR)-6-methoxy-4,7,8a-trimethyl-5-(2-oxanyloxy)-8-oxo-1,2,3,4,4a,5-hexahydronaphthalen-1-yl] ester IUPAC Name: [(1S,4R,4aS,5S,8aR)-6-methoxy-4,7,8a-trimethyl-5-(oxan-2-yloxy)-8-oxo-1,2,3,4,4a,5-hexahydronaphthalen-1-yl] propanoate Traditional Name: propionic acid [(1S,4R,4aS,5S,8aR)-8-keto-6-methoxy-4,7,8a-trimethyl-5-tetrahydropyran-2-yloxy-1,2,3,4,4a,5-hexahydronaphthalen-1-yl] ester Formula: C22H34O6 MolecularWeight: 394.50176

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1CCC(C2C1(C(=O)C(=C(C2OC3CCCCO3)OC)C)C)C

Isomeric SMILES

CCC(=O)O[C@H]1CC[C@H]([C@H]2[C@]1(C(=O)C(=C([C@H]2OC3CCCCO3)OC)C)C)C

InChI

InChI=1S/C22H34O6/c1-6-16(23)27-15-11-10-13(2)18-20(28-17-9-7-8-12-26-17)19(25-5)14(3)21(24)22(15,18)4/h13,15,17-18,20H,6-12H2,1-5H3/t13-,15+,17?,18-,20+,22+/m1/s1