Bioactive Compound Details

BioIDbio1376
NameSCULPONEATIN C
ChEMBL IDCHEMBL1081517
Molecular FormulaC20H24O6
Molecular Weight360.41
Molecular Weight (Monoisotopic)360.1573
TypeSmall molecule
Max Phase--
Target IDTar11
Target NameProto-oncogene c-RAF (c-RAF)
SynonymsSculponeatin C
SmilesC=C1C(=O)[C@]23C[C@H]1C[C@@H](O)[C@H]2[C@@]1(COC3=O)[C@@H]2[C@H]3OC[C@]2(C)CC[C@H]1O3
InchiInChI=1S/C20H24O6/c1-9-10-5-11(21)13-19(6-10,15(9)22)17(23)25-8-20(13)12-3-4-18(2)7-24-16(26-12)14(18)20/h10-14,16,21H,1,3-8H2,2H3/t10-,11-,12-,13-,14-,16+,18+,19+,20+/m1/s1
Inchi KeyJWBVQJZXSQDXKU-ZYPWQORTSA-N
Molecular SpeciesNEUTRAL
Targets3.0
Bioactivities3.0
Np Likeness Score4.02
Records Key['19']
Records Name['Sculponeatin C']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure