6-Deoxy-6-fluorocyclomaltoheptaose
TL;DR: 6-Deoxy-6-fluorocyclomaltoheptaose (CAS 6340-06-3) is a chemical compound with molecular formula C42H69FO34 and molecular weight 1136.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,3R,5R,6S,8S,10S,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-10-(fluoromethyl)-5,15,20,25,30,35-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontane-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecol
Also Known As: 6-Dfcmh, 6-Deoxy-6-fluorocyclomaltoheptaose, KST-1A0248, Mono-6-deoxy-6-fluorocyclomaltoheptaose, (1S,3R,5R,6S,8S,10S,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-10-(fluoromethyl)-5,15,20,25,30,35-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontane-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecol
| Molecular Formula | C42H69FO34 |
|---|---|
| Molecular Weight | 1136.37 g/mol |
| LogP | -14.0 |
| Topological Polar Surface Area | 534.0 Ų |
| Hydrogen Bond Donors | 20 |
| Hydrogen Bond Acceptors | 35 |
| Rotatable Bonds | 7 |
| Exact Mass | 1136.3655 |
| Heavy Atoms | 77 |
| Complexity | 1840.0 |
Chemical Identifiers
| CAS Number | 6340-06-3 |
|---|---|
| SMILES | C([C@@H]1[C@@H]2[C@@H]([C@H]([C@H](O1)O[C@@H]3[C@H](O[C@@H]([C@@H]([C@H]3O)O)O[C@@H]4[C@H](O[C@@H]([C@@H]([C@H]4O)O)O[C@@H]5[C@H](O[C@@H]([C@@H]([C@H]5O)O)O[C@@H]6[C@H](OC([C@@H]([C@H]6O)O)O[C@@H]7[C@H](O[C@@H]([C@@H]([C@H]7O)O)O[C@@H]8[C@H](O[C@H](O2)[C@@H]([C@H]8O)O)CO)CO)CO)CO)CF)CO)O)O)O |
| InChIKey | WEIPGRSBUGQBEA-LNMAUMMUSA-N |
Product Overview
6-Deoxy-6-fluorocyclomaltoheptaose (CAS 6340-06-3), with molecular formula C42H69FO34 and molecular weight 1136.37 g/mol. IUPAC: (1S,3R,5R,6S,8S,10S,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-10-(fluoromethyl)-5,15,20,25,30,35-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontane-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecol.
Chemical Property Profile of 6-Deoxy-6-fluorocyclomaltoheptaose
Property Insights of 6-Deoxy-6-fluorocyclomaltoheptaose
The XLogP value of -14.0 indicates that 6-Deoxy-6-fluorocyclomaltoheptaose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 534.0 Ų indicates high polarity, suggesting 6-Deoxy-6-fluorocyclomaltoheptaose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-Deoxy-6-fluorocyclomaltoheptaose has 20 hydrogen bond donor(s) and 35 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Deoxy-6-fluorocyclomaltoheptaose?
The CAS number of 6-Deoxy-6-fluorocyclomaltoheptaose is 6340-06-3.
What is the molecular formula of 6-Deoxy-6-fluorocyclomaltoheptaose?
The molecular formula of 6-Deoxy-6-fluorocyclomaltoheptaose is C42H69FO34.
What is the molecular weight of 6-Deoxy-6-fluorocyclomaltoheptaose?
The molecular weight of 6-Deoxy-6-fluorocyclomaltoheptaose is 1136.37 g/mol.
Where can I buy 6-Deoxy-6-fluorocyclomaltoheptaose?
You can request a quote for 6-Deoxy-6-fluorocyclomaltoheptaose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Deoxy-6-fluorocyclomaltoheptaose?
Yes, KEHONG BIO provides custom synthesis services for 6-Deoxy-6-fluorocyclomaltoheptaose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.