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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL489142
CHEMBL489142
Compound Name SYRINGETIN
ChEMBL Synonyms Syringetin
Max Phase 0
Trade Names
Molecular Formula C17H14O8

Additional synonyms for CHEMBL489142 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES COc1cc(cc(OC)c1O)C2=C(O)C(=O)c3c(O)cc(O)cc3O2
Standard InChI InChI=1S/C17H14O8/c1-23-11-3-7(4-12(24-2)14(11)20)17-16(22)1 ...
Download InChI
Standard InChI Key UZMAPBJVXOGOFT-UHFFFAOYSA-N

Alternate Forms of Compound in ChEMBL


CHEMBL489142

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
346.3 346.0689 1.84 3 125.68 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
8 4 0 8 4 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
6.29 - 2.97 1.56 2 25 0.66

Structural Alerts

There are 4 structural alerts for CHEMBL489142. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:UZMAPBJVXOGOFT-UHFFFAOYSA-N
Wikipedia Syringetin

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL489142



ACToR 4423-37-4
BindingDB 50025603
ChEBI 18215
eMolecules 4368478
EPA CompTox Dashboard DTXSID60196074
IBM Patent System C2012223E69B573C023D6FE2EE885FD1
KEGG Ligand C11620
LipidMaps LMPK12112498
Nikkaji J13.513E
PubChem 5281953
SureChEMBL SCHEMBL810981
ZINC ZINC06483609

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/UZMAPBJVXOGOFT-UHFFFAOYSA-N spacer
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