Citropten

Representations & DB's id
ChEBI:	None
ChEMBL:	CHEMBL481049
PubChem:	2775
IUPAC:	5,7-dimethoxychromen-2-one
Standard InChI:	InChI=1S/C11H10O4/c1-13-7-5-9(14-2)8-3-4-11(12)15-10(8)6-7/h3-6H,1-2H3
Standard InChI Key:	NXJCRELRQHZBQA-UHFFFAOYSA-N
SMILES:	COc1cc(OC)c2c(c1)oc(=O)cc2

Molecular propeties
AlogP:	1.81
Hydrogen bonds acceptors:	4
Hydrogen bonds donors:	0
Rotatable bonds:	2
Number of rings:	2
Molecular Weight:	206.06
Topological polar surface area:	44.8
Number of aromatic rings:	2
Fsp3:	0.182
Number of carbons:	11

Plant sources

Part of plant	Plant name	Ref.
Plant	Schisandra chinensis
Plant	Schisandra chinensis

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.
Potency	25118.9 nM	Endoplasmic reticulum-associated amyloid beta-peptide-binding protein	Q99714
Potency	3162.3 nM	Lysine-specific demethylase 4D-like	B2RXH2
Potency	28183.8 nM	Aldehyde dehydrogenase 1A1	P00352
Potency	39.8 nM	Lethal(3)malignant brain tumor-like protein 1	Q9Y468
Potency	15848.9 nM	15-hydroxyprostaglandin dehydrogenase [NAD+]	P15428
Potency	14125.4 nM	Alpha-galactosidase A	P06280
Potency	31622.8 nM	Cytochrome P450 3A4	P08684
Potency	31622.8 nM	Cytochrome P450 3A4	P08684
Potency	28183.8 nM	Beta-glucocerebrosidase	P04062
Potency	28183.8 nM	Histone acetyltransferase GCN5	Q92830
Potency	20587.8 nM	ATPase family AAA domain-containing protein 5	Q96QE3
Potency	31622.8 nM	Alpha-galactosidase A	P06280