天竺葵苷
TL;DR: 天竺葵苷 (CAS 58751-31-8) is a chemical compound with molecular formula C27H31O15+ and molecular weight 595.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
天竺葵苷
(2S,3R,4S,5S,6R)-2-[7-hydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-5-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Pelargonin, Monardin, Punicin, Pelargonin?, Salvinin?
| Molecular Formula | C27H31O15+ |
|---|---|
| Molecular Weight | 595.17 g/mol |
| LogP | -1.8505 |
| Topological Polar Surface Area | 240.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 595.1663 |
| Heavy Atoms | 42 |
| Complexity | 859.0 |
Chemical Identifiers
| CAS Number | 58751-31-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O |
| InChIKey | SLCKJKWFULXZBD-ZOTFFYTFSA-O |
Product Overview
天竺葵苷 (CAS 58751-31-8), with molecular formula C27H31O15+ and molecular weight 595.17 g/mol. IUPAC: (2S,3R,4S,5S,6R)-2-[7-hydroxy-2-(4-hydroxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-5-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of 天竺葵苷
Property Insights of 天竺葵苷
The XLogP value of -1.8505 indicates that 天竺葵苷 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 240.0 Ų indicates high polarity, suggesting 天竺葵苷 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 天竺葵苷 has 10 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 天竺葵苷?
The CAS number of 天竺葵苷 is 58751-31-8.
What is the molecular formula of 天竺葵苷?
The molecular formula of 天竺葵苷 is C27H31O15+.
What is the molecular weight of 天竺葵苷?
The molecular weight of 天竺葵苷 is 595.17 g/mol.
Where can I buy 天竺葵苷?
You can request a quote for 天竺葵苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 天竺葵苷?
Yes, KEHONG BIO provides custom synthesis services for 天竺葵苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.