11,13-Dihydrohelenalin tiglate
TL;DR: 11,13-Dihydrohelenalin tiglate (CAS 16503-32-5) is a chemical compound with molecular formula C20H26O5 and molecular weight 346.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,3aR,5R,5aR,8aR,9S,9aR)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,5-b]furan-9-yl] (E)-2-methylbut-2-enoate
Also Known As: Microhelenin C, Microhelenin A, 11,13-Dihydrohelenalin tiglate, BREVILIN A, 6-O-Togoloyldihydrohelenalin
| Molecular Formula | C20H26O5 |
|---|---|
| Molecular Weight | 346.18 g/mol |
| LogP | 2.8433 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 346.178 |
| Heavy Atoms | 25 |
| Complexity | 675.574 |
Chemical Identifiers
| CAS Number | 16503-32-5 |
|---|---|
| SMILES | C/C=C(\C)/C(=O)O[C@H]1[C@@H]2[C@@H](C(=O)O[C@@H]2C[C@H]([C@H]3[C@]1(C(=O)C=C3)C)C)C |
Product Overview
11,13-Dihydrohelenalin tiglate (CAS 16503-32-5), with molecular formula C20H26O5 and molecular weight 346.18 g/mol. IUPAC: [(1S,3aR,5R,5aR,8aR,9S,9aR)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,5-b]furan-9-yl] (E)-2-methylbut-2-enoate.
Chemical Property Profile of 11,13-Dihydrohelenalin tiglate
Property Insights of 11,13-Dihydrohelenalin tiglate
The XLogP value of 2.8433 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 11,13-Dihydrohelenalin tiglate. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 11,13-Dihydrohelenalin tiglate. Following Lipinski's Rule of Five, 11,13-Dihydrohelenalin tiglate has 0 hydrogen bond donor(s) and 5 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 11,13-Dihydrohelenalin tiglate?
The CAS number of 11,13-Dihydrohelenalin tiglate is 16503-32-5.
What is the molecular formula of 11,13-Dihydrohelenalin tiglate?
The molecular formula of 11,13-Dihydrohelenalin tiglate is C20H26O5.
What is the molecular weight of 11,13-Dihydrohelenalin tiglate?
The molecular weight of 11,13-Dihydrohelenalin tiglate is 346.18 g/mol.
Where can I buy 11,13-Dihydrohelenalin tiglate?
You can request a quote for 11,13-Dihydrohelenalin tiglate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11,13-Dihydrohelenalin tiglate?
Yes, KEHONG BIO provides custom synthesis services for 11,13-Dihydrohelenalin tiglate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.