Neocryptomerin
TL;DR: Neocryptomerin (CAS 20931-36-6) is a chemical compound with molecular formula C31H20O10 and molecular weight 552.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dihydroxy-6-[4-(5-hydroxy-7-methoxy-4-oxochromen-2-yl)phenoxy]-2-(4-hydroxyphenyl)chromen-4-one
Also Known As: Neocryptomerin, 7-O-methyl hinokiflavone, 5,7-dihydroxy-6-[4-(5-hydroxy-7-methoxy-4-oxochromen-2-yl)phenoxy]-2-(4-hydroxyphenyl)chromen-4-one, 5,7-Dihydroxy-6-[4-(5-hydroxy-7-methoxy-4-oxo-4H-1-benzopyran-2-yl)phenoxy]-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one, 5,7-dihydroxy-6-[4- phenoxy]-2-4h-1-benzopyran-4-one
| Molecular Formula | C31H20O10 |
|---|---|
| Molecular Weight | 552.11 g/mol |
| LogP | 5.8567 |
| Topological Polar Surface Area | 159.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 552.10565 |
| Heavy Atoms | 41 |
| Complexity | 2071.8108 |
Chemical Identifiers
| CAS Number | 20931-36-6 |
|---|---|
| SMILES | COC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)OC4=C(C5=C(C=C4O)OC(=CC5=O)C6=CC=C(C=C6)O)O)O |
Product Overview
Neocryptomerin (CAS 20931-36-6), with molecular formula C31H20O10 and molecular weight 552.11 g/mol. IUPAC: 5,7-dihydroxy-6-[4-(5-hydroxy-7-methoxy-4-oxochromen-2-yl)phenoxy]-2-(4-hydroxyphenyl)chromen-4-one.
Chemical Property Profile of Neocryptomerin
Property Insights of Neocryptomerin
The XLogP value of 5.8567 indicates that Neocryptomerin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 159.8 Ų indicates high polarity, suggesting Neocryptomerin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Neocryptomerin has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Neocryptomerin?
The CAS number of Neocryptomerin is 20931-36-6.
What is the molecular formula of Neocryptomerin?
The molecular formula of Neocryptomerin is C31H20O10.
What is the molecular weight of Neocryptomerin?
The molecular weight of Neocryptomerin is 552.11 g/mol.
Where can I buy Neocryptomerin?
You can request a quote for Neocryptomerin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Neocryptomerin?
Yes, KEHONG BIO provides custom synthesis services for Neocryptomerin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.