虎杖苷
TL;DR: 虎杖苷 (CAS 549-32-6) is a chemical compound with molecular formula C20H18O11 and molecular weight 434.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
虎杖苷
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxychromen-4-one
Also Known As: Reynoutrin, Guajavarin, Reinutrin, Quercetin 3-O-beta-D-xylopyranoside, quercetin-3-o-xyloside
| Molecular Formula | C20H18O11 |
|---|---|
| Molecular Weight | 434.08 g/mol |
| LogP | 0.1002 |
| Topological Polar Surface Area | 190.28 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 3 |
| Exact Mass | 434.0849 |
| Heavy Atoms | 31 |
| Complexity | 1201.9309 |
Chemical Identifiers
| CAS Number | 549-32-6 |
|---|---|
| SMILES | C1[C@H]([C@@H]([C@H]([C@@H](O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O |
Product Overview
虎杖苷 (CAS 549-32-6), with molecular formula C20H18O11 and molecular weight 434.08 g/mol. IUPAC: 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxychromen-4-one.
Chemical Property Profile of 虎杖苷
Property Insights of 虎杖苷
The XLogP value of 0.1002 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 虎杖苷. The TPSA of 190.28 Ų indicates high polarity, suggesting 虎杖苷 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 虎杖苷 has 7 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 虎杖苷?
The CAS number of 虎杖苷 is 549-32-6.
What is the molecular formula of 虎杖苷?
The molecular formula of 虎杖苷 is C20H18O11.
What is the molecular weight of 虎杖苷?
The molecular weight of 虎杖苷 is 434.08 g/mol.
Where can I buy 虎杖苷?
You can request a quote for 虎杖苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 虎杖苷?
Yes, KEHONG BIO provides custom synthesis services for 虎杖苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.