Bioactive Compound Details

BioIDbio1787
NameGLOBOSTELLATIC ACD C METHYL ESTER
ChEMBL IDCHEMBL443134
Molecular FormulaC34H50O7
Molecular Weight570.77
Molecular Weight (Monoisotopic)570.3557
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsGlobostellatic Acd C Methyl Ester
SmilesCOC(=O)[C@]1(C)[C@@H]2CC[C@]3(C)/C(=C(C)\C=C\C=C(C)\C=C\C(OC)C(C)(C)O)C(=O)C[C@@H]3[C@@]2(C)CC[C@H]1OC(C)=O
InchiInChI=1S/C34H50O7/c1-21(14-15-27(39-9)31(4,5)38)12-11-13-22(2)29-24(36)20-26-32(6)19-17-28(41-23(3)35)34(8,30(37)40-10)25(32)16-18-33(26,29)7/h11-15,25-28,38H,16-20H2,1-10H3/b13-11+,15-14+,21-12+,29-22-/t25-,26-,27?,28-,32+,33+,34-/m1/s1
Inchi KeyJKYUKDUGIIRUKJ-LPFBVOCUSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities1.0
Np Likeness Score3.0
Records Key['2']
Records Name['Globostellatic Acid C methyl ester']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure