5-Epidilatanolide B
TL;DR: 5-Epidilatanolide B (CAS 412031-40-4) is a chemical compound with molecular formula C15H20O2 and molecular weight 232.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aR,9S,9aR,9bS)-9,9a-dimethyl-3-methylidene-4,5,7,8,9,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one
Also Known As: 5-Epidilatanolide B, 5-epi-Dilatanolide B, J1.727.732D, (3aR,9S,9aR,9bS)-9,9a-Dimethyl-3-methylene-3,3a,4,5,7,8,9,9a-octahydronaphtho[1,2-b]furan-2(9bH)-one, (3aR)-3-Methylene-9alpha,9aalpha-dimethyl-3aalpha,4,5,7,8,9,9a,9balpha-octahydronaphtho[1,2-b]furan-2(3H)-one
| Molecular Formula | C15H20O2 |
|---|---|
| Molecular Weight | 232.15 g/mol |
| LogP | 3.2406 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 232.14633 |
| Heavy Atoms | 17 |
| Complexity | 420.63776 |
Chemical Identifiers
| CAS Number | 412031-40-4 |
|---|---|
| SMILES | C[C@H]1CCC=C2[C@@]1([C@@H]3[C@H](CC2)C(=C)C(=O)O3)C |
Product Overview
5-Epidilatanolide B (CAS 412031-40-4), with molecular formula C15H20O2 and molecular weight 232.15 g/mol. IUPAC: (3aR,9S,9aR,9bS)-9,9a-dimethyl-3-methylidene-4,5,7,8,9,9b-hexahydro-3aH-benzo[g][1]benzofuran-2-one.
Chemical Property Profile of 5-Epidilatanolide B
Property Insights of 5-Epidilatanolide B
The XLogP value of 3.2406 indicates that 5-Epidilatanolide B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 5-Epidilatanolide B exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Epidilatanolide B has 0 hydrogen bond donor(s) and 2 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 5-Epidilatanolide B?
The CAS number of 5-Epidilatanolide B is 412031-40-4.
What is the molecular formula of 5-Epidilatanolide B?
The molecular formula of 5-Epidilatanolide B is C15H20O2.
What is the molecular weight of 5-Epidilatanolide B?
The molecular weight of 5-Epidilatanolide B is 232.15 g/mol.
Where can I buy 5-Epidilatanolide B?
You can request a quote for 5-Epidilatanolide B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Epidilatanolide B?
Yes, KEHONG BIO provides custom synthesis services for 5-Epidilatanolide B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.