Chemical Component Summary

Name(1S,3aR,5S,7aS)-7a-methyl-5-(2,3,5-trifluoro-4-hydroxyphenyl)octahydro-1H-inden-1-ol
Identifiers(1S,3aR,5S,7aS)-7a-methyl-5-[2,3,5-tris(fluoranyl)-4-oxidanyl-phenyl]-1,2,3,3a,4,5,6,7-octahydroinden-1-ol
FormulaC16 H19 F3 O2
Molecular Weight300.316
TypeNON-POLYMER
Isomeric SMILESC[C@]12CC[C@@H](C[C@H]1CC[C@@H]2O)c3cc(c(c(c3F)F)O)F
InChIInChI=1S/C16H19F3O2/c1-16-5-4-8(6-9(16)2-3-12(16)20)10-7-11(17)15(21)14(19)13(10)18/h7-9,12,20-21H,2-6H2,1H3/t8-,9+,12-,16-/m0/s1
InChIKeyYBEWPYOAFFTAGI-YFESCLGYSA-N

Chemical Details

Formal Charge0
Atom Count40
Chiral Atom Count4
Bond Count42
Aromatic Bond Count6

Related Resource References

Resource NameReference
PubChem 50940848
ChEMBL CHEMBL1651145