Hexa-N-acetylchitohexaose

Basic Information

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CAS Number

38854-46-5

Molecular Formula

C48H80N6O31

Molecular Weight

1237.17 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Polymers and Plastics Thermoplastics Polyolefins

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

>250°C (dec.)

Specific Rotation

-11.4 º (in H2O)

SMILES

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O([C@@]1([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C([H])([H])O[H])O1)O[C@@]1([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C([H])([H])O[H])O1)O[C@@]1([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C([H])([H])O[H])O1)O[H])O[H])N([H])C(C([H])([H])[H])=O)O[H])N([H])C(C([H])([H])[H])=O)O[H])N([H])C(C([H])([H])[H])=O)[C@]1([H])[C@@]([H])(C([H])([H])O[H])O[C@]([H])([C@@]([H])([C@@]1([H])O[H])N([H])C(C([H])([H])[H])=O)O[C@]1([H])[C@@]([H])(C([H])([H])O[H])O[C@]([H])([C@@]([H])([C@@]1([H])O[H])N([H])C(C([H])([H])[H])=O)O[C@]([H])([C@@]([H])(C([H])([H])O[H])O[H])[C@@]([H])([C@]([H])(C([H])=O)N([H])C(C([H])([H])[H])=O)O[H]

InChI

1S/C48H80N6O31/c1-14(62)49-20(7-55)32(69)39(21(68)8-56)81-45-28(51-16(3)64)35(72)41(23(10-58)77-45)83-47-30(53-18(5)66)37(74)43(25(12-60)79-47)85-48-31(54-19(6)67)38(75)42(26(13-61)80-48)84-46-29(52-17(4)65)36(73)40(24(11-59)78-46)82-44-27(50-15(2)63)34(71)33(70)22(9-57)76-44/h7,20-48,56-61,68-75H,8-13H2,1-6H3,(H,49,62)(H,50,63)(H,51,64)(H,52,65)(H,53,66)(H,54,67)/t20-,21+,22+,23+,24+,25+,26+,27+,28+,29+,30+,31+,32+,33+,34+,35+,36+,37+,38+,39+,40+,41+,42+,43+,44-,45-,46-,47-,48-/m0/s1

InChIKey

FUHDMRPNDKDRFE-LPUYKFNUSA-N

LogP

-10.89220

Topological Polar Surface Area

567.1900000000002 Å²

Hydrogen Bond Donor/Acceptor

20 / 37

Complexity

2220

Synonyms & References

English

N,N',N'',N''',N''''-Pentaacetyl chitopentaose
D-Glucose,O-2-(acetylamino)-2-deoxy-b-D-glucopyranosyl-(1&reg
HEXAACETYL-CHITOHEXAOSE
N,N',N'',N''',N'''',N'''''-Hexaacetylchitohexaose
N,N?,N’’,N?’’,N?’’’,N?’’’’-Hexaacetylchitohexaose
N,N’,N’’,N’’’,N’’’’,N’’’’’-Hexaacetylchitohexaose
4)-2-(acetylamino)-2-deoxy-
4)-O-2-(
4)-O-2-(acetylamino)-2-deoxy-b-D...
4)-O-2-(acetylamino)-2-deoxy-b-D-glucopyranosyl-(1&reg
Chitin oligosaccharides DP6
Chitinhexaose
GLCNAC-BETA1-4GLCNAC-BETA1-4GLCNAC-BETA1-4GLCNAC-BETA1-4GLCNAC-BETA1-4GLCNAC
N-acetylated chitohexaose
O-2-(Acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1→4)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1→4)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1→4)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1→4)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1→4)-2-(acetylamino)-2-deoxy-D-glucose
N-Acetylchitohexaose
Hexa-N-acetylchitohexaose
N-Acetylglucosamine hexamer
N-Acetylglucosamine hexasaccharide
Chitohexaose, hexa-N-acetyl (6CI)
D-Glucose, O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1-4)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1-4)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1-4)-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1-4)-O-2-(acetylamino)-2-deoxy-bet

MDL Number

MFCD00210241

FAQ

What is Hexa-N-acetylchitohexaose (CAS: 38854-46-5)?

Hexa-N-acetylchitohexaose, also known as hexa-acetylchitohexaose, is a complex carbohydrate with a molecular formula of (C8H16O5N6)6. It is a linear polymer of N-acetylglucosamine units linked by β(1→4) glycosidic bonds, and is used primarily in research and pharmaceutical applications due to its unique chemical structure.

What are the main uses of Hexa-N-acetylchitohexaose (CAS: 38854-46-5)?

Hexa-N-acetylchitohexaose is mainly used in research and pharmaceutical applications. It is utilized for studying carbohydrate structures, as a reference material, and in the development of new drugs. Additionally, it is sometimes used in food applications for its functional properties.

Is Hexa-N-acetylchitohexaose (CAS: 38854-46-5) safe?

Hexa-N-acetylchitohexaose is generally considered safe for research and pharmaceutical use when handled with appropriate precautions. It is important to follow standard safety guidelines, including proper storage and handling procedures to avoid any potential risks.

How should Hexa-N-acetylchexaose (CAS: 38854-46-5) be stored?

Hexa-N-acetylchitohexaose should be stored in a cool, dry place away from direct sunlight and moisture. It should be kept in a tightly sealed container to protect it from air and humidity. The ideal storage conditions are between 15°C and 25°C (59°F and 77°F) to maintain its stability and purity.