Cardinalic acid
TL;DR: Cardinalic acid (CAS 97451-32-6) is a chemical compound with molecular formula C16H17NO9 and molecular weight 367.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Cardinalic acid
4-oxo-8-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1H-quinoline-2-carboxylic acid
Also Known As: Cardinalic acid, xanthurenicacid8-O-glucoside, Xanthurenic acid 8-O-glucoside, C16N17NO9, Xanthurenic acid 8-O-beta-D-glucoside
| Molecular Formula | C16H17NO9 |
|---|---|
| Molecular Weight | 367.09 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.09033 |
| Heavy Atoms | 26 |
| Complexity | 594.0 |
Chemical Identifiers
| CAS Number | 97451-32-6 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)OC3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)NC(=CC2=O)C(=O)O |
| InChIKey | MYFHOUJDPFBJLH-VQKLLNHBSA-N |
Product Overview
Cardinalic acid (CAS 97451-32-6), with molecular formula C16H17NO9 and molecular weight 367.09 g/mol. IUPAC: 4-oxo-8-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1H-quinoline-2-carboxylic acid.
Chemical Property Profile of Cardinalic acid
Property Insights of Cardinalic acid
The XLogP value of -0.9 indicates that Cardinalic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 166.0 Ų indicates high polarity, suggesting Cardinalic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cardinalic acid has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cardinalic acid?
The CAS number of Cardinalic acid is 97451-32-6.
What is the molecular formula of Cardinalic acid?
The molecular formula of Cardinalic acid is C16H17NO9.
What is the molecular weight of Cardinalic acid?
The molecular weight of Cardinalic acid is 367.09 g/mol.
Where can I buy Cardinalic acid?
You can request a quote for Cardinalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cardinalic acid?
Yes, KEHONG BIO provides custom synthesis services for Cardinalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.