Bioactive Compound Details

BioIDbio1798
NameGYMNASTERKOREAYNE C
ChEMBL IDCHEMBL463830
Molecular FormulaC19H24O3
Molecular Weight300.4
Molecular Weight (Monoisotopic)300.1725
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonymsgymnasterkoreayne C
SmilesC=CCCCCC/C=C\[C@H](O)C#CC#C[C@H](C=C)OC(C)=O
InchiInChI=1S/C19H24O3/c1-4-6-7-8-9-10-11-14-18(21)15-12-13-16-19(5-2)22-17(3)20/h4-5,11,14,18-19,21H,1-2,6-10H2,3H3/b14-11-/t18-,19-/m0/s1
Inchi KeyXLZZUDXEHSVXOR-ZUKORNFRSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score2.6
Records Key['3, gymnasterkoreayne C']
Records Name['(3S,8S)-1,9,16-heptadecatrien-4,6-diyn-3,8-diol-3-acetate']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure