Neolinustatin
TL;DR: Neolinustatin (CAS 72229-42-6) is a chemical compound with molecular formula C17H29NO11 and molecular weight 423.17407 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxybutanenitrile
Also Known As: Neolinustatin, BUTANENITRILE, KST-1A8054, SID:134222423, (2R)-2-methyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxybutanenitrile
Technical Specifications
| Molecular Formula | C17H29NO11 |
| Molecular Weight | 423.17407 g/mol |
| XLogP | -3.3 |
| Topological Polar Surface Area (TPSA) | 202.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 7 |
| Exact Mass | 423.17407 Da |
| Heavy Atoms | 29 |
| Complexity | 585.0 |
| SMILES | CC[C@](C)(C#N)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O |
| InChIKey | WOSYVGNDRYBQCQ-BARGLTKPSA-N |
Chemical Property Profile of Neolinustatin
Property Insights of Neolinustatin
The XLogP value of -3.3 indicates that Neolinustatin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 202.0 Ų indicates high polarity, suggesting Neolinustatin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Neolinustatin has 7 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Neolinustatin?
The CAS number of Neolinustatin is 72229-42-6.
What is the molecular formula of Neolinustatin?
The molecular formula of Neolinustatin is C17H29NO11.
What is the molecular weight of Neolinustatin?
The molecular weight of Neolinustatin is 423.17407 g/mol.
Where can I buy Neolinustatin?
You can request a quote for Neolinustatin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Neolinustatin?
Yes, CoreyChem provides custom synthesis services for Neolinustatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.