Swertiapunimarin
TL;DR: Swertiapunimarin (CAS 151140-40-8) is a chemical compound with molecular formula C22H32O14 and molecular weight 520.1792 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S,4R,4aS)-4-ethenyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-4,4a,5,6-tetrahydro-3H-pyrano[3,4-c]pyran-8-one
Also Known As: Swertiapunimarin, 6'-O-Glucopyranosylsweroside, 6'-O-glucopyranosyl-sweroside, KST-1A2170, 6'-O-beta-D-glucopyranosyl-sweroside
Technical Specifications
| Molecular Formula | C22H32O14 |
| Molecular Weight | 520.1792 g/mol |
| XLogP | -3.1 |
| Topological Polar Surface Area (TPSA) | 214.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 520.1792 Da |
| Heavy Atoms | 36 |
| Complexity | 821.0 |
| SMILES | C=C[C@@H]1[C@@H]2CCOC(=O)C2=CO[C@H]1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O |
| InChIKey | LILOLDYAQAFVGN-DFOQSZTGSA-N |
Chemical Property Profile of Swertiapunimarin
Property Insights of Swertiapunimarin
The XLogP value of -3.1 indicates that Swertiapunimarin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 214.0 Ų indicates high polarity, suggesting Swertiapunimarin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Swertiapunimarin has 7 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Swertiapunimarin?
The CAS number of Swertiapunimarin is 151140-40-8.
What is the molecular formula of Swertiapunimarin?
The molecular formula of Swertiapunimarin is C22H32O14.
What is the molecular weight of Swertiapunimarin?
The molecular weight of Swertiapunimarin is 520.1792 g/mol.
Where can I buy Swertiapunimarin?
You can request a quote for Swertiapunimarin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Swertiapunimarin?
Yes, CoreyChem provides custom synthesis services for Swertiapunimarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.