Linusitamarin
TL;DR: Linusitamarin (CAS 152574-84-0) is a chemical compound with molecular formula C17H22O9 and molecular weight 370.12637 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (E)-3-[3-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoate
Also Known As: Linusitamarin, LINUSITARNARIN, methyl (E)-3-[3-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoate, L-Phenylalaninamide, N-acetyl-L-leucyl-L-prolyl-N-methyl-, 2-Propenoic acid, 3-(3-(beta-D-glucopyranosyloxy)-5-methoxyphenyl)-, methyl ester, (E)-
Technical Specifications
| Molecular Formula | C17H22O9 |
| Molecular Weight | 370.12637 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 135.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 370.12637 Da |
| Heavy Atoms | 26 |
| Complexity | 483.0 |
| SMILES | COC1=CC(=CC(=C1)/C=C/C(=O)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O |
| InChIKey | USFDIQKRDRIDPN-CTYIEIGBSA-N |
Chemical Property Profile of Linusitamarin
Property Insights of Linusitamarin
The XLogP value of -0.2 indicates that Linusitamarin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Linusitamarin. Following Lipinski's Rule of Five, Linusitamarin has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Linusitamarin?
The CAS number of Linusitamarin is 152574-84-0.
What is the molecular formula of Linusitamarin?
The molecular formula of Linusitamarin is C17H22O9.
What is the molecular weight of Linusitamarin?
The molecular weight of Linusitamarin is 370.12637 g/mol.
Where can I buy Linusitamarin?
You can request a quote for Linusitamarin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Linusitamarin?
Yes, CoreyChem provides custom synthesis services for Linusitamarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.