Phyllanthocin
TL;DR: Phyllanthocin (CAS 62948-37-2) is a chemical compound with molecular formula C25H30O7 and molecular weight 442.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: PHYLLANTHOCIN, Dispiro[oxirane-2,3'(2'H)-benzofuran-2',2''-[2H]pyran]-6'-carboxylic acid, decahydro-5''-methyl-4''-[(1-oxo-3-phenyl-2-propenyl)oxy]-, methyl ester, [2'R-[2'.alpha.[4''R*(E),5''S*],3'.beta.,3'a.alpha.,6'.alpha.,7'a.alpha.]]-, Methyl 5-methyl-4-{[(2E)-3-phenylprop-2-enoyl]oxy}hexahydrodispiro[oxane-2,2'-[1]benzofuran-3',2''-oxirane]-6'-carboxylate
| Molecular Formula | C25H30O7 |
|---|---|
| Molecular Weight | 442.20 g/mol |
| LogP | 3.1214 |
| Topological Polar Surface Area | 83.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 442.19916 |
| Heavy Atoms | 32 |
| Complexity | 892.81134 |
Chemical Identifiers
| CAS Number | 62948-37-2 |
|---|---|
| SMILES | CC1COC2(CC1OC(=O)/C=C/C3=CC=CC=C3)C4(CO4)C5CCC(CC5O2)C(=O)OC |
Product Overview
Phyllanthocin (CAS 62948-37-2), with molecular formula C25H30O7 and molecular weight 442.20 g/mol.
Chemical Property Profile of Phyllanthocin
Property Insights of Phyllanthocin
The XLogP value of 3.1214 indicates that Phyllanthocin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.59 Ų falls within the moderate polarity range, balancing permeability and solubility for Phyllanthocin. Following Lipinski's Rule of Five, Phyllanthocin has 0 hydrogen bond donor(s) and 7 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 Phyllanthocin?
The CAS number of Phyllanthocin is 62948-37-2.
What is the molecular formula of Phyllanthocin?
The molecular formula of Phyllanthocin is C25H30O7.
What is the molecular weight of Phyllanthocin?
The molecular weight of Phyllanthocin is 442.20 g/mol.
Where can I buy Phyllanthocin?
You can request a quote for Phyllanthocin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phyllanthocin?
Yes, KEHONG BIO provides custom synthesis services for Phyllanthocin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.