1-[(4-hydroxyphenyl)methyl]-4-methoxyphenanthrene-2,7-diol

Modify Date: 2024-03-10 10:38:10

1-[(4-hydroxyphenyl)methyl]-4-methoxyphenanthrene-2,7-diol Structure
1-[(4-hydroxyphenyl)methyl]-4-methoxyphenanthrene-2,7-diol structure
Common Name 1-[(4-hydroxyphenyl)methyl]-4-methoxyphenanthrene-2,7-diol
CAS Number 133740-30-4 Molecular Weight 346.37600
Density N/A Boiling Point N/A
Molecular Formula C22H18O4 Melting Point N/A
MSDS N/A Flash Point N/A

 Use of 1-[(4-hydroxyphenyl)methyl]-4-methoxyphenanthrene-2,7-diol


BChE-IN-11 (compound 10) is a potent, selective and non-competitive BChE (butyrylcholinesterase) inhibitor, with an IC50 of 2.1 μM. BChE-IN-11 can be used for Alzheimer's disease (AD) research[1].

 Names

Name 1-[(4-hydroxyphenyl)methyl]-4-methoxyphenanthrene-2,7-diol
Synonym More Synonyms

  Biological Activity

Description BChE-IN-11 (compound 10) is a potent, selective and non-competitive BChE (butyrylcholinesterase) inhibitor, with an IC50 of 2.1 μM. BChE-IN-11 can be used for Alzheimer's disease (AD) research[1].
Related Catalog
Target

BChE:2.1 ± 0.3 μM (IC50)

AChE

In Vitro BChE-IN-11 (compound 10) shows inhibition activity for BChE and AChE, with inhibition of 96.6 ± 1.2% and 19.1 ± 3.8% at 25 μg/mL, respectively[1].BChE-IN-11 binds to the active pocket of BChE via multiple hydrogen bonds with His438, Pro285, Gly115 and π–π stacking with Tyr332 and Trp82[1].
References

[1]. Liu Y, et al. Biological evaluation, molecular modeling and dynamics simulation of phenanthrenes isolated from Bletilla striata as butyrylcholinesterase inhibitors. Sci Rep. 2022 Aug 11;12(1):13649.

 Chemical & Physical Properties

Molecular Formula C22H18O4
Molecular Weight 346.37600
Exact Mass 346.12100
PSA 69.92000
LogP 4.70920

 Synonyms

1-(4-hydroxybenzyl)-4-methoxyphenthrene-2,7-diol
2,7-Phenanthrenediol,1-[(4-hydroxyphenyl)methyl]-4-methoxy
1-(4'-hydroxybenzyl)-4-methoxyphenanthrene-2,7-diol
1-(p-hydroxybenzyl)-4-methoxyphenanthrene-2,7-diol