Hispidulin 7-glucuronide
TL;DR: Hispidulin 7-glucuronide (CAS 31105-76-7) is a chemical compound with molecular formula C22H20O12 and molecular weight 476.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-6-methoxy-4-oxochromen-7-yl]oxyoxane-2-carboxylic acid
Also Known As: Hispidulin 7-glucuronide, 6-O-Methylscutellarin, Hispidulin-7-O-glucuronide, MEGxp0_001401, hispidulin-7-O-beta-glucuronide
| Molecular Formula | C22H20O12 |
|---|---|
| Molecular Weight | 476.10 g/mol |
| LogP | 0.1508 |
| Topological Polar Surface Area | 196.35 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 476.0955 |
| Heavy Atoms | 34 |
| Complexity | 1281.77 |
Chemical Identifiers
| CAS Number | 31105-76-7 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1O)C(=O)C=C(O2)C3=CC=C(C=C3)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O |
Product Overview
Hispidulin 7-glucuronide (CAS 31105-76-7), with molecular formula C22H20O12 and molecular weight 476.10 g/mol. IUPAC: (2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-6-methoxy-4-oxochromen-7-yl]oxyoxane-2-carboxylic acid.
Chemical Property Profile of Hispidulin 7-glucuronide
Property Insights of Hispidulin 7-glucuronide
The XLogP value of 0.1508 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hispidulin 7-glucuronide. The TPSA of 196.35 Ų indicates high polarity, suggesting Hispidulin 7-glucuronide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hispidulin 7-glucuronide has 6 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 Hispidulin 7-glucuronide?
The CAS number of Hispidulin 7-glucuronide is 31105-76-7.
What is the molecular formula of Hispidulin 7-glucuronide?
The molecular formula of Hispidulin 7-glucuronide is C22H20O12.
What is the molecular weight of Hispidulin 7-glucuronide?
The molecular weight of Hispidulin 7-glucuronide is 476.10 g/mol.
Where can I buy Hispidulin 7-glucuronide?
You can request a quote for Hispidulin 7-glucuronide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hispidulin 7-glucuronide?
Yes, KEHONG BIO provides custom synthesis services for Hispidulin 7-glucuronide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.