Arillatose B
TL;DR: Arillatose B (CAS 137941-45-8) is a chemical compound with molecular formula C22H30O14 and molecular weight 518.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4S,5R,6R)-6-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Also Known As: Arillatose B, 6'-O-Feruloylsucrose, 6-O-FERULOYLSUCROSE, HY-N2890, J1.058.540F
| Molecular Formula | C22H30O14 |
|---|---|
| Molecular Weight | 518.16 g/mol |
| LogP | -3.4171 |
| Topological Polar Surface Area | 225.06 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 9 |
| Exact Mass | 518.1636 |
| Heavy Atoms | 36 |
| Complexity | 924.0063 |
Chemical Identifiers
| CAS Number | 137941-45-8 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C/C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O[C@]3([C@H]([C@@H]([C@H](O3)CO)O)O)CO)O)O)O)O |
Product Overview
Arillatose B (CAS 137941-45-8), with molecular formula C22H30O14 and molecular weight 518.16 g/mol. IUPAC: [(2R,3S,4S,5R,6R)-6-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate.
Chemical Property Profile of Arillatose B
Property Insights of Arillatose B
The XLogP value of -3.4171 indicates that Arillatose B is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 225.06 Ų indicates high polarity, suggesting Arillatose B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Arillatose B has 8 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 Arillatose B?
The CAS number of Arillatose B is 137941-45-8.
What is the molecular formula of Arillatose B?
The molecular formula of Arillatose B is C22H30O14.
What is the molecular weight of Arillatose B?
The molecular weight of Arillatose B is 518.16 g/mol.
Where can I buy Arillatose B?
You can request a quote for Arillatose B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Arillatose B?
Yes, KEHONG BIO provides custom synthesis services for Arillatose B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.