Feruloyl quinic acid (isomer of 887, 888)
TL;DR: Feruloyl quinic acid (isomer of 887, 888) (CAS 87099-72-7) is a chemical compound with molecular formula C17H20O9 and molecular weight 368.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,4-trihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid
Also Known As: Feruloylquinic acid, Feruloyl quinic acid, 3-O-Feruloylquinic acid, 5-O-(E)-FeruloylquinicAcid, 2-(Difluoromethyl)-5-fluoropyridin-4-amine
| Molecular Formula | C17H20O9 |
|---|---|
| Molecular Weight | 368.11 g/mol |
| LogP | -0.3429 |
| Topological Polar Surface Area | 153.75 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.11072 |
| Heavy Atoms | 26 |
| Complexity | 714.1851 |
Chemical Identifiers
| CAS Number | 87099-72-7 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C/C(=O)OC2CC(CC(C2O)O)(C(=O)O)O)O |
Product Overview
Feruloyl quinic acid (isomer of 887, 888) (CAS 87099-72-7), with molecular formula C17H20O9 and molecular weight 368.11 g/mol. IUPAC: 1,3,4-trihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid.
Chemical Property Profile of Feruloyl quinic acid (isomer of 887, 888)
Property Insights of Feruloyl quinic acid (isomer of 887, 888)
The XLogP value of -0.3429 indicates that Feruloyl quinic acid (isomer of 887, 888) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 153.75 Ų indicates high polarity, suggesting Feruloyl quinic acid (isomer of 887, 888) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Feruloyl quinic acid (isomer of 887, 888) has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Feruloyl quinic acid (isomer of 887, 888)?
The CAS number of Feruloyl quinic acid (isomer of 887, 888) is 87099-72-7.
What is the molecular formula of Feruloyl quinic acid (isomer of 887, 888)?
The molecular formula of Feruloyl quinic acid (isomer of 887, 888) is C17H20O9.
What is the molecular weight of Feruloyl quinic acid (isomer of 887, 888)?
The molecular weight of Feruloyl quinic acid (isomer of 887, 888) is 368.11 g/mol.
Where can I buy Feruloyl quinic acid (isomer of 887, 888)?
You can request a quote for Feruloyl quinic acid (isomer of 887, 888) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Feruloyl quinic acid (isomer of 887, 888)?
Yes, KEHONG BIO provides custom synthesis services for Feruloyl quinic acid (isomer of 887, 888) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.