Cyclohexapentylose

Catalog Number	ACM10016203-3
CAS	10016-20-3
Structure
Synonyms	Cyclohexaamylose carbonate
Molecular Weight	972.8
Molecular Formula	C36H60O30
Canonical SMILES	C(C1C2C(C(C(O1)OC3C(OC(C(C3O)O)OC4C(OC(C(C4O)O)OC5C(OC(C(C5O)O)OC6C(OC(C(C6O)O)OC7C(OC(O2)C(C7O)O)CO)CO)CO)CO)CO)O)O)O
InChI	InChI=1S/C36H60O30/c37-1-7-25-13(43)19(49)31(55-7)62-26-8(2-38)57-33(21(51)15(26)45)64-28-10(4-40)59-35(23(53)17(28)47)66-30-12(6-42)60-36(24(54)18(30)48)65-29-11(5-41)58-34(22(52)16(29)46)63-27-9(3-39)56-32(61-25)20(50)14(27)44/h7-54H,1-6H2/t7-,8-,9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-/m1/s1
InChI Key	HFHDHCJBZVLPGP-RWMJIURBSA-N
Melting Point	>278 °C
Purity	98%+
Appearance	powder
Complexity	1250
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	30
Exact Mass	972.31694049
Heavy Atom Count	66
Hydrogen Bond Acceptor Count	30
Hydrogen Bond Donor Count	18
Isomeric 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](O[C@@H]([C@@H]([C@H]6O)O)O[C@@H]7[C@H](O[C@H](O2)[C@@H]([C@H]7O)O)CO)CO)CO)CO)CO)O)O)O
Monoisotopic Mass	972.31694049
Physical State	Powder
Rotatable Bond Count	6
Topological Polar Surface Area	475 Ų

Knowledge & Learning Case Study Q&A

Cyclohexapentylose for the Development of a pH/Enzyme Dual-responsive System based on Mesoporous Silica

Feng J, et al. Journal of Environmental Chemical Engineering, 2024, 12(2), 112406.

α-Cyclohexapentylose (α-CD) and dopamine (DA) were encapsulated on the surface of mesoporous silica nanoparticles (MSNs) loaded with indoxacarb (IN) to obtain pH and enzyme dual-responsive nanoparticles (IN@MSN@PDA@α-CD).
The specific method is as follows.
Preparation of IN@MSN: 300 mg of IN was dissolved in 10 mL of dichloromethane, after which 200 mg of MSN was added to the solution. The mixture was sonicated for 30 minutes and then magnetically stirred for 6 hours at 25 ± 2°C. The resulting precipitate was collected by centrifugation (8000 rpm, 5 minutes), washed three times with anhydrous ethanol and deionized water, and then vacuum-dried at 60°C for 12 hours to produce IN@MSN powder.
Preparation of IN@MSN@PDA: 100 mg of IN@MSN was added to 20 mL of Tris-HCl buffer (pH 8.5) and stirred magnetically for 30 minutes. A specific amount of DA was then introduced and the mixture was stirred in the dark for 24 hours at 25 ± 2°C. After centrifugation, the supernatant was discarded, and the precipitate was washed with deionized water and ethanol.
Preparation of IN@MSN@PDA@α-CD: 100 mg of IN@MSN@PDA was dispersed in 50 mL of 2% α-CD solution, sonicated for 20 minutes, and stirred at 80°C for 10 hours. The mixture was then centrifuged, washed, and vacuum-dried to yield MSN@PDA@α-CD. The final product, IN@MSN@PDA@α-CD, was obtained using the same procedure.

What is the molecular formula of Cyclohexapentylose?

The molecular formula of Cyclohexapentylose is C36H60O30.

What is the molecular weight of Cyclohexapentylose?

The molecular weight of Cyclohexapentylose is 972.8 g/mol.

What are some other synonyms for Cyclohexapentylose?

Some synonyms for Cyclohexapentylose include alpha-CYCLODEXTRIN, Alfadex, and Cyclomaltohexaose.

What is the IUPAC name of Cyclohexapentylose?

The IUPAC name of Cyclohexapentylose is (1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31R,32R,33R,34R,35R,36R,37R,38R,39R,40R,41R,42R)-5,10,15,20,25,30-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.2 3,6 .2 8,11 .2 13,16 .2 18,21 .2 23,26 ]dotetracontane-31,32,33,34,35,36,37,38,39,40,41,42-dodecol.

What is the InChIKey of Cyclohexapentylose?

The InChIKey of Cyclohexapentylose is HFHDHCJBZVLPGP-RWMJIURBSA-N.

What is the canonical SMILES representation of Cyclohexapentylose?

The canonical SMILES of Cyclohexapentylose is C(C1C2C(C(C(O1)OC3C(OC(C(C3O)O)OC4C(OC(C(C4O)O)OC5C(OC(C(C5O)O)OC6C(OC(C(C6O)O)OC7C(OC(O2)C(C7O)O)CO)CO)CO)CO)CO)CO)O)O)O.

What is the CAS number of Cyclohexapentylose?

The CAS number of Cyclohexapentylose is 10016-20-3.

What is the EC number of Cyclohexapentylose?

The EC number of Cyclohexapentylose is 233-007-4.

What is the ChEMBL ID of Cyclohexapentylose?

The ChEMBL ID of Cyclohexapentylose is CHEMBL1230813.

What is the Wikipedia page for Cyclohexapentylose?

The Wikipedia page for Cyclohexapentylose is "Alpha-Cyclodextrin".

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Cyclohexapentylose (10016-20-3)

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