(2E,6E,8S,9S,10R)-8-methoxy-10-methyl-9-oxidanyl-cyclododeca-2,6-dien-1-one

Systemtic Name: (2E,6E,8S,9S,10R)-8-methoxy-10-methyl-9-oxidanyl-cyclododeca-2,6-dien-1-one Openeye Name: (2E,6E,8S,9S,10R)-9-hydroxy-8-methoxy-10-methyl-cyclododeca-2,6-dien-1-one CAS Name: (2E,6E,8S,9S,10R)-9-hydroxy-8-methoxy-10-methyl-1-cyclododeca-2,6-dienone IUPAC Name: (2E,6E,8S,9S,10R)-9-hydroxy-8-methoxy-10-methylcyclododeca-2,6-dien-1-one Traditional Name: (2E,6E,8S,9S,10R)-9-hydroxy-8-methoxy-10-methyl-cyclododeca-2,6-dien-1-one Formula: C14H22O3 MolecularWeight: 238.32268

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=O)C=CCCC=CC(C1O)OC

Isomeric SMILES

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

InChI

InChI=1S/C14H22O3/c1-11-9-10-12(15)7-5-3-4-6-8-13(17-2)14(11)16/h5-8,11,13-14,16H,3-4,9-10H2,1-2H3/b7-5+,8-6+/t11-,13+,14+/m1/s1