莰狄宁
TL;DR: 莰狄宁 (CAS 2753-30-2) is a chemical compound with molecular formula C28H34O7 and molecular weight 482.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
莰狄宁
[7-(furan-3-yl)-1,8,12,16,16-pentamethyl-5,15-dioxo-3,6-dioxapentacyclo[9.8.0.02,4.02,8.012,17]nonadec-13-en-19-yl] acetate
Also Known As: gedunin, Gedunine, Phosphinic acid, tetradecyl-, NCI60_000302, (3-furyl-pentamethyl-dioxo-[?]yl) acetate
| Molecular Formula | C28H34O7 |
|---|---|
| Molecular Weight | 482.23 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 95.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 482.23044 |
| Heavy Atoms | 35 |
| Complexity | 1030.0 |
Chemical Identifiers
| CAS Number | 2753-30-2 |
|---|---|
| SMILES | CC(=O)OC1CC2C(C(=O)C=CC2(C3C1(C45C(O4)C(=O)OC(C5(CC3)C)C6=COC=C6)C)C)(C)C |
| InChIKey | YJXDGWUNRYLINJ-UHFFFAOYSA-N |
Product Overview
莰狄宁 (CAS 2753-30-2), with molecular formula C28H34O7 and molecular weight 482.23 g/mol. IUPAC: [7-(furan-3-yl)-1,8,12,16,16-pentamethyl-5,15-dioxo-3,6-dioxapentacyclo[9.8.0.02,4.02,8.012,17]nonadec-13-en-19-yl] acetate.
Chemical Property Profile of 莰狄宁
Property Insights of 莰狄宁
The XLogP value of 4.2 indicates that Gedunine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 莰狄宁. Following Lipinski's Rule of Five, Gedunine has 0 hydrogen bond donor(s) and 7 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 Gedunine?
The CAS number of Gedunine is 2753-30-2.
What is the molecular formula of Gedunine?
The molecular formula of Gedunine is C28H34O7.
What is the molecular weight of Gedunine?
The molecular weight of Gedunine is 482.23 g/mol.
Where can I buy Gedunine?
You can request a quote for Gedunine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Gedunine?
Yes, KEHONG BIO provides custom synthesis services for Gedunine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.