General Characteristics
2D structure
NatID 1391
Common Name NatID_1391
Molecular Formula C15H12O3
Chemical Class Linear 1,3-diarylpropanoids > Chalcones and dihydrochalcones
Molecular Weight 240.079 g/mol
Other names

 

Representations
Smiles O=C(/C=C/c1ccccc1)c1ccc(O)cc1O
Inchi InChI=1S/C15H12O3/c16-12-7-8-13(15(18)10-12)14(17)9-6-11-4-2-1-3-5-11/h1-10,16,18H/b9-6+
Inchi Key JUMSUVHHUVPSOY-RMKNXTFCSA-N
3D Structure

 

Calculated Properties
clogP 2.99
TPSA 57.53
HBD 2
HBA 3
Rotatable Bonds 3
Aromatic Rings 2
Heavy Atoms 18
Aromatic Carbocycles 2
Aromatic Heterocycles 0
Number of NO 3

 

Experiments
EID Source Semisynthetic? Confidence level References
9931 Flourensia oolepis No High Joray, M. B., Trucco, L. D., González, M. L., Napal, G. N. D., Palacios, S. M., Bocco, J. L., & Carpinella, M. C. (2015). Antibacterial and Cytotoxic Activity of Compounds Isolated fromFlourensia oolepis. Evidence-Based Complementary and Alternative Medicine, 2015, 1–11. https://doi.org/10.1155/2015/912484
10025 Zuccagnia punctata No High Svetaz, L., Agüero, M., Alvarez, S., Luna, L., Feresin, G., Derita, M., Tapia, A., & Zacchino, S. (2007). Antifungal Activity of Zuccagnia punctata Cav.: Evidence for the Mechanism of Action. Planta Medica, 73(10), 1074–1080. https://doi.org/10.1055/s-2007-981561

 

Bioassay ID NPASS ID Target Activity type Activity