Bioactive Compound Details

BioIDbio1712
NameDYVARIABILIN C
ChEMBL IDCHEMBL516631
Molecular FormulaC30H48O4
Molecular Weight472.71
Molecular Weight (Monoisotopic)472.3553
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsDyvariabilin C
SmilesC[C@H](C[C@@H](O)[C@@H]1OC1(C)C)[C@@H]1CC[C@]2(C)[C@@]34O[C@H]3C[C@H]3C(C)(C)C(=O)CC[C@]3(C)[C@H]4CC[C@@]12C
InchiInChI=1S/C30H48O4/c1-17(15-19(31)24-26(4,5)34-24)18-9-14-29(8)28(18,7)13-10-20-27(6)12-11-22(32)25(2,3)21(27)16-23-30(20,29)33-23/h17-21,23-24,31H,9-16H2,1-8H3/t17-,18+,19-,20-,21+,23+,24+,27-,28+,29+,30+/m1/s1
Inchi KeyCTMMURJXADRKDF-ZTWPDPRHSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score3.41
Records Key['3']
Records Name['dyvariabilin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure