Limonilic acid
TL;DR: Limonilic acid (CAS 751-49-5) is a chemical compound with molecular formula C26H30O9 and molecular weight 486.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(furan-3-yl)-5,12,16,16-tetramethyl-8,13-dioxo-7,10,17,20-tetraoxahexacyclo[12.4.2.01,15.02,12.05,11.09,11]icosan-18-yl]acetic acid
Also Known As: LIMONILIC ACID, Limonoic acid,19-epoxy-, 16,17-lactone, Limonoic acid, 19-deoxy-6,19-epoxy-, 16,17-lactone, 19-Deoxy-6beta,19-epoxylimonoic acid 16,17-lactone, 2-[6-(furan-3-yl)-5,12,16,16-tetramethyl-8,13-dioxo-7,10,17,20-tetraoxahexacyclo[12.4.2.01,15.02,12.05,11.09,11]icosan-18-yl]acetic acid
| Molecular Formula | C26H30O9 |
|---|---|
| Molecular Weight | 486.19 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 486.189 |
| Heavy Atoms | 35 |
| Complexity | 1040.0 |
Chemical Identifiers
| CAS Number | 751-49-5 |
|---|---|
| SMILES | CC1(C2C3C(=O)C4(C(C2(CO3)C(O1)CC(=O)O)CCC5(C46C(O6)C(=O)OC5C7=COC=C7)C)C)C |
| InChIKey | WCUZRQHRKOLHQW-UHFFFAOYSA-N |
Product Overview
Limonilic acid (CAS 751-49-5), with molecular formula C26H30O9 and molecular weight 486.19 g/mol. IUPAC: 2-[6-(furan-3-yl)-5,12,16,16-tetramethyl-8,13-dioxo-7,10,17,20-tetraoxahexacyclo[12.4.2.01,15.02,12.05,11.09,11]icosan-18-yl]acetic acid.
Chemical Property Profile of Limonilic acid
Property Insights of Limonilic acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Limonilic acid. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Limonilic acid. Following Lipinski's Rule of Five, Limonilic acid has 1 hydrogen bond donor(s) and 9 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 Limonilic acid?
The CAS number of Limonilic acid is 751-49-5.
What is the molecular formula of Limonilic acid?
The molecular formula of Limonilic acid is C26H30O9.
What is the molecular weight of Limonilic acid?
The molecular weight of Limonilic acid is 486.19 g/mol.
Where can I buy Limonilic acid?
You can request a quote for Limonilic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Limonilic acid?
Yes, KEHONG BIO provides custom synthesis services for Limonilic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.