Swertipunicoside
TL;DR: Swertipunicoside (CAS 137570-21-9) is a chemical compound with molecular formula C33H26O17 and molecular weight 694.117 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3,6,7-tetrahydroxy-2-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4-(1,4,8-trihydroxy-6-methoxy-9-oxoxanthen-2-yl)xanthen-9-one
Also Known As: Swertipunicoside, 1,3,6,7-tetrahydroxy-2-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4-(1,4,8-trihydroxy-6-methoxy-9-oxoxanthen-2-yl)xanthen-9-one, (2,4'-Bi-9H-xanthene)-9,9'-dione, 2'-beta-D-glucopyranosyl-1,1',3',4,6',7',8-heptahydroxy-6-methoxy-, (1S)-1,5-anhydro-1-(1,1',3',4,6',7',8-heptahydroxy-6-methoxy-9,9'-dioxo-9H,9'H-2,4'-bixanthen-2'-yl)-D-glucitol, 1,5,8-Trihydroxy-3-methoxy-7-(1',3',6',7'-tetrahydroxy-9'-oxo-4'-xanthyl)xanthone-2'-C-beta-D-glucopyranoside
Technical Specifications
| Molecular Formula | C33H26O17 |
| Molecular Weight | 694.117 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 294.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 4 |
| Exact Mass | 694.117 Da |
| Heavy Atoms | 50 |
| Complexity | 1270.0 |
| SMILES | COC1=CC(=C2C(=C1)OC3=C(C=C(C(=C3C2=O)O)C4=C5C(=C(C(=C4O)[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)C(=O)C7=CC(=C(C=C7O5)O)O)O)O |
| InChIKey | GNMLPEJAIRBAAO-FLJAPRSHSA-N |
Chemical Property Profile of Swertipunicoside
Property Insights of Swertipunicoside
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Swertipunicoside. The TPSA of 294.0 Ų indicates high polarity, suggesting Swertipunicoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Swertipunicoside has 11 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Swertipunicoside?
The CAS number of Swertipunicoside is 137570-21-9.
What is the molecular formula of Swertipunicoside?
The molecular formula of Swertipunicoside is C33H26O17.
What is the molecular weight of Swertipunicoside?
The molecular weight of Swertipunicoside is 694.117 g/mol.
Where can I buy Swertipunicoside?
You can request a quote for Swertipunicoside directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Swertipunicoside?
Yes, CoreyChem provides custom synthesis services for Swertipunicoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.