Isoplumericin
TL;DR: Isoplumericin (CAS 31298-76-7) is a chemical compound with molecular formula C15H14O6 and molecular weight 290.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1S,4S,8R,10S,11Z,14S)-11-ethylidene-12-oxo-7,9,13-trioxatetracyclo[6.5.1.01,10.04,14]tetradeca-2,5-diene-5-carboxylate
Also Known As: Isoplumericin, Plumericin, ISOPLUMERICINE, (1R,5S,8S,9S,10S)-Isoplumericin, methyl (Z)-ethylidene(oxo)[?]carboxylate
| Molecular Formula | C15H14O6 |
|---|---|
| Molecular Weight | 290.08 g/mol |
| LogP | 0.8425 |
| Topological Polar Surface Area | 71.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.07904 |
| Heavy Atoms | 21 |
| Complexity | 630.0751 |
Chemical Identifiers
| CAS Number | 31298-76-7 |
|---|---|
| SMILES | C/C=C\1/[C@H]2[C@@]3(C=C[C@H]4[C@@H]3[C@@H](O2)OC=C4C(=O)OC)OC1=O |
Product Overview
Isoplumericin (CAS 31298-76-7), with molecular formula C15H14O6 and molecular weight 290.08 g/mol. IUPAC: methyl (1S,4S,8R,10S,11Z,14S)-11-ethylidene-12-oxo-7,9,13-trioxatetracyclo[6.5.1.01,10.04,14]tetradeca-2,5-diene-5-carboxylate.
Chemical Property Profile of Isoplumericin
Property Insights of Isoplumericin
The XLogP value of 0.8425 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isoplumericin. The TPSA of 71.06 Ų falls within the moderate polarity range, balancing permeability and solubility for Isoplumericin. Following Lipinski's Rule of Five, Isoplumericin has 0 hydrogen bond donor(s) and 6 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 Isoplumericin?
The CAS number of Isoplumericin is 31298-76-7.
What is the molecular formula of Isoplumericin?
The molecular formula of Isoplumericin is C15H14O6.
What is the molecular weight of Isoplumericin?
The molecular weight of Isoplumericin is 290.08 g/mol.
Where can I buy Isoplumericin?
You can request a quote for Isoplumericin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoplumericin?
Yes, KEHONG BIO provides custom synthesis services for Isoplumericin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.