Bioactive Compound Details

BioIDbio1425
NameCYTOGLOBOSIN C
ChEMBL IDCHEMBL1097579
Molecular FormulaC32H38N2O5
Molecular Weight530.67
Molecular Weight (Monoisotopic)530.2781
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsCytoglobosin C
SmilesCC1=C(C)[C@H]2[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@]23C(=O)/C=C/[C@H](O)[C@H](O)/C(C)=C/[C@@H](C)C/C=C/[C@H]3[C@@H]1O
InchiInChI=1S/C32H38N2O5/c1-17-8-7-10-23-30(38)20(4)19(3)28-25(15-21-16-33-24-11-6-5-9-22(21)24)34-31(39)32(23,28)27(36)13-12-26(35)29(37)18(2)14-17/h5-7,9-14,16-17,23,25-26,28-30,33,35,37-38H,8,15H2,1-4H3,(H,34,39)/b10-7+,13-12+,18-14+/t17-,23-,25-,26-,28-,29+,30+,32+/m0/s1
Inchi KeyVWKVHGIGUCPWKR-HDCYGHGWSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities3.0
Np Likeness Score2.36
Records Key['3']
Records Name['Cytoglobosin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure