6-O-(2-hydroxypropyl)cyclomaltoheptaose
TL;DR: 6-O-(2-hydroxypropyl)cyclomaltoheptaose (CAS 152203-30-0) is a chemical compound with molecular formula C135H290O139 and molecular weight 4135.56 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris((1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-5,10,15,20,30,35-hexakis(hydroxymethyl)-25-[[(2R)-2-hydroxypropoxy]methyl]-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);hentriacontahydrate
Also Known As: 6-O-Hopr-cmhdextrin, 6-O-(2-Ohpr)-beta-CD, 6-O-(2-Hydroxypropyl)cyclomaltoheptaose, 6-O-(2-Hydroxypropyl)-beta-cyclodextrin, (1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-5,10,15,20,30,35-hexakis(hydroxymethyl)-25-[[(2R)-2-hydroxypropoxy]methyl]-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;hentriacontahydrate
| Molecular Formula | C135H290O139 |
|---|---|
| Molecular Weight | 4135.56 g/mol |
| LogP | -70.0422 |
| Topological Polar Surface Area | 2666.34 Ų |
| Hydrogen Bond Donors | 63 |
| Hydrogen Bond Acceptors | 108 |
| Rotatable Bonds | 30 |
| Exact Mass | 4135.5625 |
| Heavy Atoms | 274 |
| Complexity | 6365.1187 |
Chemical Identifiers
| CAS Number | 152203-30-0 |
|---|---|
| SMILES | C[C@H](COC[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](O[C@@H]([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)CO)CO)O)O)O.C[C@H](COC[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](O[C@@H]([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)CO)CO)O)O)O.C[C@H](COC[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](O[C@@H]([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)CO)CO)O)O)O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O |
Product Overview
6-O-(2-hydroxypropyl)cyclomaltoheptaose (CAS 152203-30-0), with molecular formula C135H290O139 and molecular weight 4135.56 g/mol. IUPAC: tris((1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-5,10,15,20,30,35-hexakis(hydroxymethyl)-25-[[(2R)-2-hydroxypropoxy]methyl]-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);hentriacontahydrate.
Chemical Property Profile of 6-O-(2-hydroxypropyl)cyclomaltoheptaose
Property Insights of 6-O-(2-hydroxypropyl)cyclomaltoheptaose
The XLogP value of -70.0422 indicates that 6-O-(2-hydroxypropyl)cyclomaltoheptaose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 2666.34 Ų indicates high polarity, suggesting 6-O-(2-hydroxypropyl)cyclomaltoheptaose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-O-(2-hydroxypropyl)cyclomaltoheptaose has 63 hydrogen bond donor(s) and 108 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-O-(2-hydroxypropyl)cyclomaltoheptaose?
The CAS number of 6-O-(2-hydroxypropyl)cyclomaltoheptaose is 152203-30-0.
What is the molecular formula of 6-O-(2-hydroxypropyl)cyclomaltoheptaose?
The molecular formula of 6-O-(2-hydroxypropyl)cyclomaltoheptaose is C135H290O139.
What is the molecular weight of 6-O-(2-hydroxypropyl)cyclomaltoheptaose?
The molecular weight of 6-O-(2-hydroxypropyl)cyclomaltoheptaose is 4135.56 g/mol.
Where can I buy 6-O-(2-hydroxypropyl)cyclomaltoheptaose?
You can request a quote for 6-O-(2-hydroxypropyl)cyclomaltoheptaose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-O-(2-hydroxypropyl)cyclomaltoheptaose?
Yes, KEHONG BIO provides custom synthesis services for 6-O-(2-hydroxypropyl)cyclomaltoheptaose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.