Narirutin
TL;DR: Narirutin (CAS 108815-81-2) is a chemical compound with molecular formula C27H32O14 and molecular weight 580.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Also Known As: Narirutin, Isonaringin, Isonaringenin, Nairutin, (2S)-Narirutin
| Molecular Formula | C27H32O14 |
|---|---|
| Molecular Weight | 580.18 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 225.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 6 |
| Exact Mass | 580.1792 |
| Heavy Atoms | 41 |
| Complexity | 884.0 |
Chemical Identifiers
| CAS Number | 108815-81-2 |
|---|---|
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=CC(=C4C(=O)C[C@H](OC4=C3)C5=CC=C(C=C5)O)O)O)O)O)O)O)O |
| InChIKey | HXTFHSYLYXVTHC-AJHDJQPGSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Narirutin (CAS 108815-81-2), with molecular formula C27H32O14 and molecular weight 580.18 g/mol. IUPAC: (2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one.
Chemical Property Profile of Narirutin
Property Insights of Narirutin
The XLogP value of -1.1 indicates that Narirutin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 225.0 Ų indicates high polarity, suggesting Narirutin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Narirutin has 8 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Narirutin?
The CAS number of Narirutin is 108815-81-2.
What is the molecular formula of Narirutin?
The molecular formula of Narirutin is C27H32O14.
What is the molecular weight of Narirutin?
The molecular weight of Narirutin is 580.18 g/mol.
Where can I buy Narirutin?
You can request a quote for Narirutin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Narirutin?
Yes, KEHONG BIO provides custom synthesis services for Narirutin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.