4-Nonylphenol

Representations & DB's id
ChEBI:	CHEBI:34440
ChEMBL:	CHEMBL153062
PubChem:	1752
IUPAC:	4-nonylphenol
Standard InChI:	InChI=1S/C15H24O/c1-2-3-4-5-6-7-8-9-14-10-12-15(16)13-11-14/h10-13,16H,2-9H2,1H3
Standard InChI Key:	IGFHQQFPSIBGKE-UHFFFAOYSA-N
SMILES:	CCCCCCCCCc1ccc(cc1)O

Molecular propeties
AlogP:	4.69
Hydrogen bonds acceptors:	1
Hydrogen bonds donors:	1
Rotatable bonds:	8
Number of rings:	1
Molecular Weight:	220.18
Topological polar surface area:	20.2
Number of aromatic rings:	1
Fsp3:	0.6
Number of carbons:	15

Plant sources

Part of plant	Plant name	Ref.
Plant	Schisandra chinensis

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.
Kd	1202.26 nM	Testis-specific androgen-binding protein	P04278
Potency	14125.4 nM	Prelamin-A/C	P02545
Potency	39810.7 nM	Endoplasmic reticulum-associated amyloid beta-peptide-binding protein	Q99714
Potency	35481.3 nM	Lysine-specific demethylase 4D-like	B2RXH2
Potency	79432.8 nM	Hypoxia-inducible factor 1 alpha	Q16665
Potency	39810.7 nM	Aldehyde dehydrogenase 1A1	P00352
Potency	100000 nM	Aldehyde dehydrogenase 1A1	P00352
Potency	25118.9 nM	Cellular tumor antigen p53	P04637
Potency	25118.9 nM	Endoplasmic reticulum-associated amyloid beta-peptide-binding protein	Q99714
Potency	31622.8 nM	Cytochrome P450 3A4	P08684
Potency	31622.8 nM	Cytochrome P450 3A4	P08684
Potency	44668.4 nM	Nuclear factor NF-kappa-B p105 subunit	P19838
Potency	74978 nM	Nuclear factor erythroid 2-related factor 2	Q16236
Potency	30637.9 nM	Nuclear factor erythroid 2-related factor 2	Q16236
Potency	66824.2 nM	Nuclear receptor ROR-gamma	P51449