Bioactive Compound Details

BioIDbio1215
NameNone
ChEMBL IDCHEMBL457252
Molecular FormulaC26H38O6
Molecular Weight446.58
Molecular Weight (Monoisotopic)446.2668
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonyms10-Desacetyltaxuyunnanine C
SmilesC=C1[C@@H](OC(C)=O)CC[C@@]2(C)C[C@H](OC(C)=O)C3=C(C)C[C@H](OC(C)=O)[C@@H](C[C@H]12)C3(C)C
InchiInChI=1S/C26H38O6/c1-14-11-22(31-17(4)28)20-12-19-15(2)21(30-16(3)27)9-10-26(19,8)13-23(32-18(5)29)24(14)25(20,6)7/h19-23H,2,9-13H2,1,3-8H3/t19-,20-,21+,22+,23+,26+/m1/s1
Inchi KeyIZZSSHPUMGSXRG-RECADABPSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities2.0
Np Likeness Score2.63
Records Key['10-desacetyltaxuyunnanine C']
Records Name['10-desacetyltaxuyunnanine C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure