Chemical Component Summary

Name4,4'-{[(3S)-3-(methylsulfanyl)cyclohexylidene]methanediyl}diphenol
Identifiers4-[(4-hydroxyphenyl)-[(3S)-3-methylsulfanylcyclohexylidene]methyl]phenol
FormulaC20 H22 O2 S
Molecular Weight326.452
TypeNON-POLYMER
Isomeric SMILESCS[C@H]1CCCC(=C(c2ccc(cc2)O)c3ccc(cc3)O)C1
InChIInChI=1S/C20H22O2S/c1-23-19-4-2-3-16(13-19)20(14-5-9-17(21)10-6-14)15-7-11-18(22)12-8-15/h5-12,19,21-22H,2-4,13H2,1H3/t19-/m0/s1
InChIKeyOTONLNOSZVKIHK-IBGZPJMESA-N

Chemical Details

Formal Charge0
Atom Count45
Chiral Atom Count1
Bond Count47
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 137348364