Liriodendrin
TL;DR: Liriodendrin (CAS 573-44-4) is a chemical compound with molecular formula C46H66O30 and molecular weight 1098.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4S,5S,6R)-2-[2-[6-[2,4-dimethoxy-3,6-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]phenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-3,5-dimethoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Liriodendrin, Acanthoside D, 2-Bromo-3-nitrobenzoic acid, beta-D-Glucopyranoside, (tetrahydro-1H,3H-furo(3,4-c)furan-1,4-diyl)bis(2,6-dimethoxy-4,1-phenylenebis-, (1S-(1alpha,3aalpha,4alpha,6aalpha))-, (2S,3R,4S,5S,6R)-2-[2-[6-[2,4-dimethoxy-3,6-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]phenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-3,5-dimethoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
| Molecular Formula | C46H66O30 |
|---|---|
| Molecular Weight | 1098.36 g/mol |
| LogP | -7.489 |
| Topological Polar Surface Area | 452.9 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 30 |
| Rotatable Bonds | 18 |
| Exact Mass | 1098.3639 |
| Heavy Atoms | 76 |
| Complexity | 2098.7458 |
Chemical Identifiers
| CAS Number | 573-44-4 |
|---|---|
| SMILES | COC1=C(C(=C(C(=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C3C4COC(C4CO3)C5=C(C(=C(C=C5O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)OC)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)OC)OC)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O |
Product Overview
Liriodendrin (CAS 573-44-4), with molecular formula C46H66O30 and molecular weight 1098.36 g/mol. IUPAC: (2S,3R,4S,5S,6R)-2-[2-[6-[2,4-dimethoxy-3,6-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]phenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-3,5-dimethoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of Liriodendrin
Property Insights of Liriodendrin
The XLogP value of -7.489 indicates that Liriodendrin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 452.9 Ų indicates high polarity, suggesting Liriodendrin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Liriodendrin has 16 hydrogen bond donor(s) and 30 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Liriodendrin?
The CAS number of Liriodendrin is 573-44-4.
What is the molecular formula of Liriodendrin?
The molecular formula of Liriodendrin is C46H66O30.
What is the molecular weight of Liriodendrin?
The molecular weight of Liriodendrin is 1098.36 g/mol.
Where can I buy Liriodendrin?
You can request a quote for Liriodendrin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Liriodendrin?
Yes, KEHONG BIO provides custom synthesis services for Liriodendrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.