Neocryptomerin

Neocryptomerin, a biflavonoid, shows inhibitory activity against U251, MCF-7, HeLa cell. Neocryptomerin has favorable binding affinities in the active pocket of SARS-CoV-2. Neocryptomerin is the leading compound of rational compounds against COVID-19[1][2].

Product Specifications

CAS Number

[20931-36-6]

UNSPSC

12352005

Target

SARS-CoV

Type

Natural Products

Related Pathways

Anti-infection

Applications

Cancer-programmed cell death

Field of Research

Cancer

Assay Protocol

https://www.medchemexpress.com/neocryptomerin.html

Purity

99.14

Solubility

DMSO : 50 mg/mL (ultrasonic)

Smiles

OC1=CC(OC)=CC(OC(C2=CC=C(OC3=C(O)C4=C(OC(C5=CC=C(O)C=C5)=CC4=O)C=C3O)C=C2)=C6)=C1C6=O

Molecular Formula

C31H20O10

Molecular Weight

552.48

References & Citations

[1]Guo-gang Zhang, et al. Isolation and cytotoxic activity of selaginellin derivatives and biflavonoids from Selaginella tamariscina. Planta Med. 2012 Mar;78 (4) :390-2.|[2]Yufei Ma, et al. Exploration of plant-derived natural polyphenols toward COVID-19 main protease inhibitors: DFT, molecular docking approach, and molecular dynamics simulations. RSC Adv. 2022 Feb 14;12 (9) :5357-5368.