Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL251059

SINAPALDEHYDE GLUCOSIDE
Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
COc1cc(/C=C/C=O)cc(OC)c1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL251059
Name SINAPALDEHYDE GLUCOSIDE
Phase Preclinical
Structure Type MOL
InChI Key OYTCTPHTVUEGCL-GCPOEHJPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
6
Publications
0
Known Names

Molecular Properties

370.4
MW (Da)
-0.91
ALogP
9
HBA
4
HBD
134.9
PSA (Ų)
0.36
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C17H22O9
MW 370.35
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness 1.86

Literature References

PubMed DOI Target Context # Activities
34658231 10.1021/acs.jnatprod.1c00585 RAW264.7 2
17918910 10.1021/np070388c HeLa 1
17918910 10.1021/np070388c A549 1
17918910 10.1021/np070388c K562 1
21955940 10.1016/j.bmcl.2011.08.089 NON-PROTEIN TARGET 1
21955940 10.1016/j.bmcl.2011.08.089 Radical scavenging activity 1

Data from ChEMBL 36 via Core Engine