1-Methoxyphaseollidin
TL;DR: 1-Methoxyphaseollidin (CAS 65428-13-9) is a chemical compound with molecular formula C21H22O5 and molecular weight 354.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6aR,11aR)-1-methoxy-10-(3-methylbut-2-enyl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol
Also Known As: 1-Methoxyphaseollidin, (-)-1-Methoxyphaseollidin, (6aR,11aR)-1-methoxy-10-(3-methylbut-2-enyl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol, (6aR,11aR)-1-Methoxy-10-(3-methyl-but-2-enyl)-6a,11a-dihydro-6H-benzofuro[3,2-c][1]benzopyran-3,9-diol, (6aR,11aR)-6a,11a-Dihydro-1-methoxy-10-(3-methyl-2-buten-1-yl)-6H-benzofuro[3,2-c][1]benzopyran-3,9-diol
| Molecular Formula | C21H22O5 |
|---|---|
| Molecular Weight | 354.15 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.14673 |
| Heavy Atoms | 26 |
| Complexity | 530.0 |
Chemical Identifiers
| CAS Number | 65428-13-9 |
|---|---|
| SMILES | CC(=CCC1=C(C=CC2=C1O[C@@H]3[C@H]2COC4=C3C(=CC(=C4)O)OC)O)C |
| InChIKey | YKTZRMXYANFKQR-YCRPNKLZSA-N |
Product Overview
1-Methoxyphaseollidin (CAS 65428-13-9), with molecular formula C21H22O5 and molecular weight 354.15 g/mol. IUPAC: (6aR,11aR)-1-methoxy-10-(3-methylbut-2-enyl)-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromene-3,9-diol.
Chemical Property Profile of 1-Methoxyphaseollidin
Property Insights of 1-Methoxyphaseollidin
The XLogP value of 4.2 indicates that 1-Methoxyphaseollidin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methoxyphaseollidin. Following Lipinski's Rule of Five, 1-Methoxyphaseollidin has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Methoxyphaseollidin?
The CAS number of 1-Methoxyphaseollidin is 65428-13-9.
What is the molecular formula of 1-Methoxyphaseollidin?
The molecular formula of 1-Methoxyphaseollidin is C21H22O5.
What is the molecular weight of 1-Methoxyphaseollidin?
The molecular weight of 1-Methoxyphaseollidin is 354.15 g/mol.
Where can I buy 1-Methoxyphaseollidin?
You can request a quote for 1-Methoxyphaseollidin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methoxyphaseollidin?
Yes, KEHONG BIO provides custom synthesis services for 1-Methoxyphaseollidin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.