Bioactive Compound Details

BioIDbio1811
NameALBOPILOSIN C
ChEMBL IDCHEMBL515844
Molecular FormulaC22H32O6
Molecular Weight392.49
Molecular Weight (Monoisotopic)392.2199
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonymsalbopilosin C
SmilesC=C1[C@H]2[C@@H](O)[C@@]3([C@H](O)C[C@H]4[C@@](C)(CCC[C@]4(C)C=O)[C@@H]3C[C@@H]2O)[C@@H]1OC(C)=O
InchiInChI=1S/C22H32O6/c1-11-17-13(25)8-15-21(4)7-5-6-20(3,10-23)14(21)9-16(26)22(15,18(17)27)19(11)28-12(2)24/h10,13-19,25-27H,1,5-9H2,2-4H3/t13-,14+,15-,16+,17+,18+,19+,20+,21+,22+/m0/s1
Inchi KeyKHZOGQHLEYJQTH-XGALNGSSSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score3.44
Records Key['2, albopilosin C']
Records Name['7alpha,12alpha,14beta-trihydroxy-15beta-acetoxy-ent-kaur-16-en-18-al']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure