Swertiamaroside
TL;DR: Swertiamaroside (CAS 17388-39-5) is a chemical compound with molecular formula C16H22O10 and molecular weight 374.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,4R)-4-ethenyl-4a-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydropyrano[3,4-c]pyran-8-one
Also Known As: Swertiamaroside, Swertiamarin, Swertiamarine, Swertiamarin (6CI,7CI,8CI), J3.248.277E
| Molecular Formula | C16H22O10 |
|---|---|
| Molecular Weight | 374.12 g/mol |
| LogP | -2.0 |
| Topological Polar Surface Area | 155.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 374.1213 |
| Heavy Atoms | 26 |
| Complexity | 592.0 |
Chemical Identifiers
| CAS Number | 17388-39-5 |
|---|---|
| SMILES | C=C[C@H]1[C@@H](OC=C2C1(CCOC2=O)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O |
| InChIKey | HEYZWPRKKUGDCR-MQADLURCSA-N |
Product Overview
Swertiamaroside (CAS 17388-39-5), with molecular formula C16H22O10 and molecular weight 374.12 g/mol. IUPAC: (3S,4R)-4-ethenyl-4a-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydropyrano[3,4-c]pyran-8-one.
Chemical Property Profile of Swertiamaroside
Property Insights of Swertiamaroside
The XLogP value of -2.0 indicates that Swertiamaroside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 155.0 Ų indicates high polarity, suggesting Swertiamaroside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Swertiamaroside has 5 hydrogen bond donor(s) and 10 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 Swertiamaroside?
The CAS number of Swertiamaroside is 17388-39-5.
What is the molecular formula of Swertiamaroside?
The molecular formula of Swertiamaroside is C16H22O10.
What is the molecular weight of Swertiamaroside?
The molecular weight of Swertiamaroside is 374.12 g/mol.
Where can I buy Swertiamaroside?
You can request a quote for Swertiamaroside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Swertiamaroside?
Yes, KEHONG BIO provides custom synthesis services for Swertiamaroside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.