瑞香苷
TL;DR: 瑞香苷 (CAS 486-55-5) is a chemical compound with molecular formula C15H16O9 and molecular weight 340.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
瑞香苷
8-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
Also Known As: Daphnin, Daphnoside, Daphnin (Standard), DAPHNIN [MI], HY-N7252R
| Molecular Formula | C15H16O9 |
|---|---|
| Molecular Weight | 340.08 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.07944 |
| Heavy Atoms | 24 |
| Complexity | 495.0 |
Chemical Identifiers
| CAS Number | 486-55-5 |
|---|---|
| SMILES | C1=CC(=C(C2=C1C=CC(=O)O2)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O |
| InChIKey | HOIXTKAYCMNVMY-PVOAASPHSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
瑞香苷 (CAS 486-55-5), with molecular formula C15H16O9 and molecular weight 340.08 g/mol. IUPAC: 8-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one.
Chemical Property Profile of 瑞香苷
Property Insights of 瑞香苷
The XLogP value of -0.6 indicates that 瑞香苷 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 146.0 Ų indicates high polarity, suggesting 瑞香苷 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 瑞香苷 has 5 hydrogen bond donor(s) and 9 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 瑞香苷?
The CAS number of 瑞香苷 is 486-55-5.
What is the molecular formula of 瑞香苷?
The molecular formula of 瑞香苷 is C15H16O9.
What is the molecular weight of 瑞香苷?
The molecular weight of 瑞香苷 is 340.08 g/mol.
Where can I buy 瑞香苷?
You can request a quote for 瑞香苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 瑞香苷?
Yes, KEHONG BIO provides custom synthesis services for 瑞香苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.