Purpureaside C
TL;DR: Purpureaside C (CAS 108648-07-3) is a chemical compound with molecular formula C35H46O20 and molecular weight 786.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-2-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] 3-(3,4-dihydroxyphenyl)prop-2-enoate
Also Known As: Purpureaside C
| Molecular Formula | C35H46O20 |
|---|---|
| Molecular Weight | 786.26 g/mol |
| LogP | -2.1 |
| Topological Polar Surface Area | 324.0 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 14 |
| Exact Mass | 786.25824 |
| Heavy Atoms | 55 |
| Complexity | 1230.0 |
Chemical Identifiers
| CAS Number | 108648-07-3 |
|---|---|
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](O[C@@H]([C@H]2OC(=O)C=CC3=CC(=C(C=C3)O)O)CO[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)OCCC5=CC(=C(C=C5)O)O)O)O)O)O |
| InChIKey | FSBUXLDOLNLABB-ADKKKDNXSA-N |
Product Overview
Purpureaside C (CAS 108648-07-3), with molecular formula C35H46O20 and molecular weight 786.26 g/mol. IUPAC: [(2R,3R,4R,5R,6R)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-2-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] 3-(3,4-dihydroxyphenyl)prop-2-enoate.
Chemical Property Profile of Purpureaside C
Property Insights of Purpureaside C
The XLogP value of -2.1 indicates that Purpureaside C is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 324.0 Ų indicates high polarity, suggesting Purpureaside C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Purpureaside C has 12 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Purpureaside C?
The CAS number of Purpureaside C is 108648-07-3.
What is the molecular formula of Purpureaside C?
The molecular formula of Purpureaside C is C35H46O20.
What is the molecular weight of Purpureaside C?
The molecular weight of Purpureaside C is 786.26 g/mol.
Where can I buy Purpureaside C?
You can request a quote for Purpureaside C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Purpureaside C?
Yes, KEHONG BIO provides custom synthesis services for Purpureaside C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.