Lactucin
TL;DR: Lactucin (CAS 19013-22-0) is a chemical compound with molecular formula C15H16O5 and molecular weight 276.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aR,4R,9aS,9bR)-4-hydroxy-9-(hydroxymethyl)-6-methyl-3-methylidene-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-2,7-dione
Also Known As: Lactucin, Lactucine, 11beta,13-Dihydrolactucin, KST-1A2341, (3aR,4R,9aS,9bR)-4-hydroxy-9-(hydroxymethyl)-6-methyl-3-methylidene-2H,3H,3aH,4H,5H,7H,9aH,9bH-azuleno[4,5-b]furan-2,7-dione
| Molecular Formula | C15H16O5 |
|---|---|
| Molecular Weight | 276.10 g/mol |
| LogP | 0.2829 |
| Topological Polar Surface Area | 83.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 276.09976 |
| Heavy Atoms | 20 |
| Complexity | 583.0713 |
Chemical Identifiers
| CAS Number | 19013-22-0 |
|---|---|
| SMILES | CC1=C2[C@@H]([C@@H]3[C@@H]([C@@H](C1)O)C(=C)C(=O)O3)C(=CC2=O)CO |
Product Overview
Lactucin (CAS 19013-22-0), with molecular formula C15H16O5 and molecular weight 276.10 g/mol. IUPAC: (3aR,4R,9aS,9bR)-4-hydroxy-9-(hydroxymethyl)-6-methyl-3-methylidene-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-2,7-dione.
Chemical Property Profile of Lactucin
Property Insights of Lactucin
The XLogP value of 0.2829 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Lactucin. The TPSA of 83.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Lactucin. Following Lipinski's Rule of Five, Lactucin has 2 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 Lactucin?
The CAS number of Lactucin is 19013-22-0.
What is the molecular formula of Lactucin?
The molecular formula of Lactucin is C15H16O5.
What is the molecular weight of Lactucin?
The molecular weight of Lactucin is 276.10 g/mol.
Where can I buy Lactucin?
You can request a quote for Lactucin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lactucin?
Yes, KEHONG BIO provides custom synthesis services for Lactucin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.