Bioactive Compound Details

BioIDbio83470
NameNone
ChEMBL IDCHEMBL1940608
Molecular FormulaC28H26O6
Molecular Weight458.51
Molecular Weight (Monoisotopic)458.1729
TypeSmall molecule
Max Phase--
Target IDTar54
Target NameNone
Synonyms(2R,5'R)-Chartaceone A1
SmilesO=C(O)CCC[C@H](/C=C/c1ccccc1)c1c(O)cc2c(c1O)C(=O)C[C@H](c1ccccc1)O2
InchiInChI=1S/C28H26O6/c29-21-17-24-27(22(30)16-23(34-24)19-10-5-2-6-11-19)28(33)26(21)20(12-7-13-25(31)32)15-14-18-8-3-1-4-9-18/h1-6,8-11,14-15,17,20,23,29,33H,7,12-13,16H2,(H,31,32)/b15-14+/t20-,23-/m1/s1
Inchi KeySBOVSSLXUHHHLZ-WKWUPWNMSA-N
Molecular SpeciesACID
Targets2.0
Bioactivities3.0
Np Likeness Score1.6
Records Key['1a, Chartaceone A1']
Records Name[(2R,5''R)-chartaceone A1"]"
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure