(6E,10E)-1-(2-hydroxyethylsulfanyl)-2,6,10-trimethyl-12-oxidanyl-dodeca-6,10-dien-3-one

Systemtic Name: (6E,10E)-1-(2-hydroxyethylsulfanyl)-2,6,10-trimethyl-12-oxidanyl-dodeca-6,10-dien-3-one Openeye Name: (6E,10E)-12-hydroxy-1-(2-hydroxyethylsulfanyl)-2,6,10-trimethyl-dodeca-6,10-dien-3-one CAS Name: (6E,10E)-12-hydroxy-1-(2-hydroxyethylthio)-2,6,10-trimethyl-3-dodeca-6,10-dienone IUPAC Name: (6E,10E)-12-hydroxy-1-(2-hydroxyethylsulfanyl)-2,6,10-trimethyldodeca-6,10-dien-3-one Traditional Name: (6E,10E)-12-hydroxy-1-(2-hydroxyethylthio)-2,6,10-trimethyl-dodeca-6,10-dien-3-one Formula: C17H30O3S MolecularWeight: 314.4833

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCCO)C(=O)CCC(=CCCC(=CCO)C)C

Isomeric SMILES

CC(CSCCO)C(=O)CC/C(=C/CC/C(=C/CO)/C)/C

InChI

InChI=1S/C17H30O3S/c1-14(5-4-6-15(2)9-10-18)7-8-17(20)16(3)13-21-12-11-19/h5,9,16,18-19H,4,6-8,10-13H2,1-3H3/b14-5+,15-9+