Bioactive Compound Details

BioIDbio200143
NameTRIETHYL CITRATE
ChEMBL IDCHEMBL464988
Molecular FormulaC12H20O7
Molecular Weight276.29
Molecular Weight (Monoisotopic)276.1209
TypeSmall molecule
Max PhaseUnknown
Target IDTar81
Target NameNone
SynonymsCITRIC ACID, TRIETHYL ESTER|CITROFLEX 2|CITROFLEX C 2|CITROFLEX EC|CITROFLEX SC 60|CITROFOL AI|E-1505|E1505|EUDRAFLEX|FEMA NO. 3083|HYDRAGEN CAT|INS NO.1505|INS-1505|MORFLEX C 2|MORFLEX TEC|NSC-8907|TRIETHYL CITRATE
SmilesCCOC(=O)CC(O)(CC(=O)OCC)C(=O)OCC
InchiInChI=1S/C12H20O7/c1-4-17-9(13)7-12(16,11(15)19-6-3)8-10(14)18-5-2/h16H,4-8H2,1-3H3
Inchi KeyDOOTYTYQINUNNV-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets2.0
Bioactivities2.0
Np Likeness Score0.63
Records Key['TRIETHYL CITRATE', 'TEE', 'SID144210324', 'Triethyl citrate']
Records Name['TRIETHYL CITRATE', 'triethyl 2-hydroxypropane-1,2,3-tricarboxylate', 'SID144210324', 'Triethyl citrate']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure