Bioactive Compound Details

BioIDbio1746
NameCROSSBYANOL C
ChEMBL IDCHEMBL1097914
Molecular FormulaC30H15Br7O9S
Molecular Weight1110.84
Molecular Weight (Monoisotopic)1103.472
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsCrossbyanol C
SmilesO=S(=O)(O)Oc1ccc(Oc2c(Br)cc(Oc3ccc(O)c(Br)c3)cc2Oc2ccc(Br)cc2Br)c(Br)c1Oc1ccc(Br)cc1Br
InchiInChI=1S/C30H15Br7O9S/c31-14-1-5-23(19(34)9-14)43-27-13-17(42-16-3-4-22(38)18(33)11-16)12-21(36)29(27)45-25-7-8-26(46-47(39,40)41)30(28(25)37)44-24-6-2-15(32)10-20(24)35/h1-13,38H,(H,39,40,41)
Inchi KeyZEPFKNVSWFBTOK-UHFFFAOYSA-N
Molecular SpeciesNone
Targets3.0
Bioactivities4.0
Np Likeness ScoreNone
Records Key['3']
Records Name['Crossbyanol C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure