Bioactive Compound Details

BioIDbio785
NameNone
ChEMBL IDCHEMBL1641889
Molecular FormulaC24H34O7
Molecular Weight434.53
Molecular Weight (Monoisotopic)434.2305
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
Synonyms3-acetyleriocasin C
SmilesC=C(C=O)[C@@H]1CC[C@@H]2[C@@H](C1)C(=O)[C@@H](O)[C@@H]1[C@](C)(COC(C)=O)[C@@H](OC(C)=O)CC[C@]12C
InchiInChI=1S/C24H34O7/c1-13(11-25)16-6-7-18-17(10-16)20(28)21(29)22-23(18,4)9-8-19(31-15(3)27)24(22,5)12-30-14(2)26/h11,16-19,21-22,29H,1,6-10,12H2,2-5H3/t16-,17-,18-,19+,21-,22+,23+,24-/m1/s1
Inchi KeyLKBMNVLYWWORRA-QLKQUVKYSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities3.0
Np Likeness Score3.03
Records Key['5, 3-acetyleriocasin C']
Records Name['6beta,19-diacetoxy-6beta-hydroxy-7,16-dioxo-ent-abieta-15(17)-ene']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure