Methyl 1'-epiacarviosin
TL;DR: Methyl 1'-epiacarviosin (CAS 140148-00-1) is a chemical compound with molecular formula C14H25NO8 and molecular weight 335.15802 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,2S,3R,6R)-6-[[(2R,3S,4S,5R,6S)-4,5-dihydroxy-6-methoxy-2-methyloxan-3-yl]amino]-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol
Also Known As: Acarviosin, Methyl 1'-epiacarviosin, Methyl 1/'-epiacarviosin, (1S,2S,3R,6R)-6-[[(2R,3S,4S,5R,6S)-4,5-dihydroxy-6-methoxy-2-methyloxan-3-yl]amino]-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol, Methyl 4,6-dideoxy-4-{[(1R,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-alpha-D-glucopyranoside
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H25NO8 |
| Molecular Weight | 335.15802 g/mol |
| XLogP | -3.7 |
| Topological Polar Surface Area (TPSA) | 152.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 335.15802 Da |
| Heavy Atoms | 23 |
| Complexity | 433.0 |
| SMILES | C[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC)O)O)N[C@@H]2C=C([C@H]([C@@H]([C@H]2O)O)O)CO |
| InChIKey | KFHKERRGDZTZQJ-YMRGHLOJSA-N |
Chemical Property Profile of Methyl 1'-epiacarviosin
Property Insights of Methyl 1'-epiacarviosin
The XLogP value of -3.7 indicates that Methyl 1'-epiacarviosin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 152.0 Ų indicates high polarity, suggesting Methyl 1'-epiacarviosin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl 1'-epiacarviosin has 7 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Methyl 1'-epiacarviosin?
The CAS number of Methyl 1'-epiacarviosin is 140148-00-1.
What is the molecular formula of Methyl 1'-epiacarviosin?
The molecular formula of Methyl 1'-epiacarviosin is C14H25NO8.
What is the molecular weight of Methyl 1'-epiacarviosin?
The molecular weight of Methyl 1'-epiacarviosin is 335.15802 g/mol.
Where can I buy Methyl 1'-epiacarviosin?
You can request a quote for Methyl 1'-epiacarviosin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 1'-epiacarviosin?
Yes, CoreyChem provides custom synthesis services for Methyl 1'-epiacarviosin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.