Bioactive Compound Details

BioIDbio198319
NameNone
ChEMBL IDCHEMBL1795556
Molecular FormulaC27H46O3
Molecular Weight418.66
Molecular Weight (Monoisotopic)418.3447
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms5-(2'-Oxoheneicosyl)Resorcinol
SmilesCCCCCCCCCCCCCCCCCCCC(=O)Cc1cc(O)cc(O)c1
InchiInChI=1S/C27H46O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)20-24-21-26(29)23-27(30)22-24/h21-23,29-30H,2-20H2,1H3
Inchi KeyBENPXLIQKFYNHW-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score0.54
Records Key['11']
Records Name[5-(2'-Oxoheneicosyl)resorcinol"]"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure