Griffonin
TL;DR: Griffonin (CAS 63492-69-3) is a chemical compound with molecular formula C14H19NO8 and molecular weight 329.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[(4R,5S,6S)-4,5-dihydroxy-6-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohex-2-en-1-ylidene]acetonitrile
Also Known As: Griffonin, Lithospermoside, Griffonia simplicifolia extracts, (2Z)-2-[(4R,5S,6S)-4,5-dihydroxy-6-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohex-2-en-1-ylidene]acetonitrile, Acetonitrile, (6-(beta-D-glucopyranosyloxy)-4,5-dihydroxy-2-cyclohexen-1-ylidene)-, (12,4alpha,5beta,6alpha)-(-)-
| Molecular Formula | C14H19NO8 |
|---|---|
| Molecular Weight | 329.11 g/mol |
| LogP | -3.08692 |
| Topological Polar Surface Area | 163.63 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.11105 |
| Heavy Atoms | 23 |
| Complexity | 513.39685 |
Chemical Identifiers
| CAS Number | 63492-69-3 |
|---|---|
| SMILES | C1=C/C(=C/C#N)/[C@@H]([C@H]([C@@H]1O)O)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)CO)O)O)O |
Product Overview
Griffonin (CAS 63492-69-3), with molecular formula C14H19NO8 and molecular weight 329.11 g/mol. IUPAC: (2Z)-2-[(4R,5S,6S)-4,5-dihydroxy-6-[(2S,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohex-2-en-1-ylidene]acetonitrile.
Chemical Property Profile of Griffonin
Property Insights of Griffonin
The XLogP value of -3.08692 indicates that Griffonin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 163.63 Ų indicates high polarity, suggesting Griffonin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Griffonin has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Griffonin?
The CAS number of Griffonin is 63492-69-3.
What is the molecular formula of Griffonin?
The molecular formula of Griffonin is C14H19NO8.
What is the molecular weight of Griffonin?
The molecular weight of Griffonin is 329.11 g/mol.
Where can I buy Griffonin?
You can request a quote for Griffonin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Griffonin?
Yes, KEHONG BIO provides custom synthesis services for Griffonin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.