Daphnorin
TL;DR: Daphnorin (CAS 6341-65-7) is a chemical compound with molecular formula C25H22O12 and molecular weight 514.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-3-(2-oxochromen-7-yl)oxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
Also Known As: daphnorin, Daphnorine, Daphnoretin-7-O-beta-D-glucoside, 6-methoxy-3-(2-oxochromen-7-yl)oxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one, 6-methoxy-2-oxo-3-[(2-oxo-2h-chromen-7-yl)oxy]-2h-chromen-7-yl
| Molecular Formula | C25H22O12 |
|---|---|
| Molecular Weight | 514.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 170.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 514.11115 |
| Heavy Atoms | 37 |
| Complexity | 919.0 |
Chemical Identifiers
| CAS Number | 6341-65-7 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C=C(C(=O)O2)OC3=CC4=C(C=C3)C=CC(=O)O4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O |
| InChIKey | WYIIRKFHBPIFQZ-FGBFUVBKSA-N |
Product Overview
Daphnorin (CAS 6341-65-7), with molecular formula C25H22O12 and molecular weight 514.11 g/mol. IUPAC: 6-methoxy-3-(2-oxochromen-7-yl)oxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one.
Chemical Property Profile of Daphnorin
Property Insights of Daphnorin
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Daphnorin. The TPSA of 170.0 Ų indicates high polarity, suggesting Daphnorin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Daphnorin has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Daphnorin?
The CAS number of Daphnorin is 6341-65-7.
What is the molecular formula of Daphnorin?
The molecular formula of Daphnorin is C25H22O12.
What is the molecular weight of Daphnorin?
The molecular weight of Daphnorin is 514.11 g/mol.
Where can I buy Daphnorin?
You can request a quote for Daphnorin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Daphnorin?
Yes, KEHONG BIO provides custom synthesis services for Daphnorin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.