2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone
TL;DR: 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone (CAS 2494-62-4) is a chemical compound with molecular formula C27H34O8 and molecular weight 486.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[7-(furan-3-yl)-1,8,12,15,15-pentamethyl-5,18-dioxo-3,6,14-trioxapentacyclo[9.7.0.02,4.02,8.012,16]octadecan-13-yl]acetate
Also Known As: 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone
| Molecular Formula | C27H34O8 |
|---|---|
| Molecular Weight | 486.23 g/mol |
| LogP | 3.7735 |
| Topological Polar Surface Area | 104.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 486.22537 |
| Heavy Atoms | 35 |
| Complexity | 1108.4235 |
Chemical Identifiers
| CAS Number | 2494-62-4 |
|---|---|
| SMILES | CC1(C2CC(=O)C3(C(C2(C(O1)CC(=O)OC)C)CCC4(C35C(O5)C(=O)OC4C6=COC=C6)C)C)C |
Product Overview
2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone (CAS 2494-62-4), with molecular formula C27H34O8 and molecular weight 486.23 g/mol. IUPAC: methyl 2-[7-(furan-3-yl)-1,8,12,15,15-pentamethyl-5,18-dioxo-3,6,14-trioxapentacyclo[9.7.0.02,4.02,8.012,16]octadecan-13-yl]acetate.
Chemical Property Profile of 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone
Property Insights of 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone
The XLogP value of 3.7735 indicates that 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone. Following Lipinski's Rule of Five, 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone has 0 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 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone?
The CAS number of 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone is 2494-62-4.
What is the molecular formula of 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone?
The molecular formula of 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone is C27H34O8.
What is the molecular weight of 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone?
The molecular weight of 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone is 486.23 g/mol.
Where can I buy 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone?
You can request a quote for 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone?
Yes, KEHONG BIO provides custom synthesis services for 2-Descarboxy-2-(methoxycarbonyl)-19-deoxylimonoic acid 16,17-lactone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.