4-[[2-(hydroxymethyl)phenyl]methylsulfanylmethyl]-2-methoxy-3-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-4-oxidanyl-cyclohexan-1-one

Systemtic Name: 4-[[2-(hydroxymethyl)phenyl]methylsulfanylmethyl]-2-methoxy-3-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-4-oxidanyl-cyclohexan-1-one Openeye Name: 4-hydroxy-4-[[2-(hydroxymethyl)phenyl]methylsulfanylmethyl]-2-methoxy-3-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]cyclohexanone CAS Name: 4-hydroxy-4-[[[2-(hydroxymethyl)phenyl]methylthio]methyl]-2-methoxy-3-[2-methyl-3-(3-methylbut-2-enyl)-2-oxiranyl]-1-cyclohexanone IUPAC Name: 4-hydroxy-4-[[2-(hydroxymethyl)phenyl]methylsulfanylmethyl]-2-methoxy-3-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]cyclohexan-1-one Traditional Name: 4-hydroxy-2-methoxy-3-[2-methyl-3-(3-methylbut-2-enyl)oxiran-2-yl]-4-[[(2-methylolbenzyl)thio]methyl]cyclohexanone Formula: C24H34O5S MolecularWeight: 434.58876

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1C(O1)(C)C2C(C(=O)CCC2(CSCC3=CC=CC=C3CO)O)OC)C

Isomeric SMILES

CC(=CCC1C(O1)(C)C2C(C(=O)CCC2(CSCC3=CC=CC=C3CO)O)OC)C

InChI

InChI=1S/C24H34O5S/c1-16(2)9-10-20-23(3,29-20)22-21(28-4)19(26)11-12-24(22,27)15-30-14-18-8-6-5-7-17(18)13-25/h5-9,20-22,25,27H,10-15H2,1-4H3