Bioactive Compound Details

BioIDbio206
NameCRYPTOCARYOL C
ChEMBL IDCHEMBL1784374
Molecular FormulaC30H56O8
Molecular Weight544.77
Molecular Weight (Monoisotopic)544.3975
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsCryptocaryol C
SmilesCCCCCCCCCCCCCCC[C@@H](O)C[C@H](O)C[C@H](O)C[C@H](O)C[C@H](O)C[C@@H]1OC(=O)C=C[C@@H]1O
InchiInChI=1S/C30H56O8/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23(31)18-24(32)19-25(33)20-26(34)21-27(35)22-29-28(36)16-17-30(37)38-29/h16-17,23-29,31-36H,2-15,18-22H2,1H3/t23-,24+,25+,26+,27+,28+,29+/m1/s1
Inchi KeyLCODPNNXGVNGAW-KVARLTFLSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score1.52
Records Key['3']
Records Name['Cryptocaryol C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure