β-D-Glucan from barley - ≥80% , CAS No.9041-22-9

CAS: 9041-22-9 Cat. No.: G121060 EC Number: 805-632-8

GRADE & PURITY ≥80%

Synonyms

44FQ49X6UN | beta-Glucans | (2S,3R,4S,5S,6R)-2-[(2R,4R,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol | CCRIS 8998 | beta-Glucan | b-D-glucan-from oat

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview

β-D-Glucan is a biomarker for the fungal infection, candidiasis. In a clinical study β-D-glucan levels was found to have poβible usefulneβ in prediction of patient outcomes.

Specifications

Synonyms

44FQ49X6UN | beta-Glucans | (2S, 3R, 4S, 5S, 6R)-2-[(2R, 4R, 5R, 6S)-4, 5-dihydroxy-2-(hydroxymethyl)-6-[(2R, 4R, 5R, 6S)-4, 5, 6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3, 4, 5-triol | CCRIS 8998 | beta-Glucan | b-D-glucan-from oat

Specifications & Purity

≥80%

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥80%

Names and Identifiers

• Pubchem Sid: 504758696
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504758696
• Canonical Smiles: C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3C(OC(C(C3O)O)O)CO)CO)O)O)O)O
• IUPAC Name: (2S,3R,4S,5S,6R)-2-[(2R,4R,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(2R,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
• InChIKey: FYGDTMLNYKFZSV-URKRLVJHSA-N
• INCHI: 1S/C18H32O16/c19-1-4-7(22)8(23)12(27)17(31-4)34-15-6(3-21)32-18(13(28)10(15)25)33-14-5(2-20)30-16(29)11(26)9(14)24/h4-29H,1-3H2/t4-,5-,6-,7-,8+,9-,10-,11-,12-,13-,14?,15?,16+,17+,18+/m1/s1
• Isomeric SMILES: C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC2[C@H](O[C@H]([C@@H]([C@H]2O)O)OC3[C@H](O[C@@H]([C@@H]([C@H]3O)O)O)CO)CO)O)O)O)O
• WGK Germany: 3
• Reaxy-Rn: 35986877
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=35986877&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Oligosaccharides
• Alternative Parents: O-glycosyl compounds Oxanes Secondary alcohols Hemiacetals Polyols Oxacyclic compounds Acetals Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Oligosaccharide - O-glycosyl compound - Glycosyl compound - Oxane - Secondary alcohol - Hemiacetal - Oxacycle - Organoheterocyclic compound - Polyol - Acetal - Hydrocarbon derivative - Primary alcohol - Alcohol - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as oligosaccharides. These are carbohydrates made up of 3 to 10 monosaccharide units linked to each other through glycosidic bonds.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Molecular Weight: 504.400 g/mol
• XLogP3: -6.900
• Hydrogen Bond Donor Count: 11
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 7
• Exact Mass: 504.169 Da
• Monoisotopic Mass: 504.169 Da
• Topological Polar Surface Area: 269.000 Ų
• Heavy Atom Count: 34
• Formal Charge: 0
• Complexity: 641.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 13
• Undefined Atom Stereocenter Count: 2
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

References

1. Zhongyu Shi, Xiasen Wei, Yunfan Wei, Zheyi Zhang, Sibao Wan, Haiyan Gao, Zhen Qin.  (2024)  Biochemical properties and application of a multi-domain β-1,3-1,4-glucanase from Fibrobacter sp..  INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,      [PMID:38852722] [10.1016/j.ijbiomac.2024.133026]

2. Wen-Xuan Qi, Feng Liu, Fang-Fang Liu, Hai-Yan Ren, Bang-Xian Zhang, Xiao-Qiang Yu, Xiang-Jun Rao.  (2024)  Discovery and characterization of a novel Lepidoptera-specific antimicrobial peptide from the fall armyworm, Spodoptera frugiperda (Lepidoptera: Noctuidae).  Insect Science,      [PMID:39552199] [10.1111/1744-7917.13471]

3. Tianxiang Zhu, Songlin Liu, Yu Gao, Xiongjie Sun, Haiming Hu, Zhigang Zhang, Wenwen Zhang, Lei Xiong, Hongtao Liu.  (2025)  Functional Characterization of a Highly Efficient Endoglucanase from Bacillus licheniformis BJ2022 and Its Application in the Preparation of Low-Molecular-Weight Konjac Glucomannan.  JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY,      [PMID:40139964] [10.1021/acs.jafc.4c10714]

4. Keyu Lin, Zhongyu Shi, Zheyi Zhang, Yunfan Wei, Sibao Wan, Haiyan Gao, Zhen Qin.  (2025)  Module architecture analysis and application of glycoside hydrolase family 148 thermostable β-1,3-1,4-glucanase.  INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,      [PMID:40081705] [10.1016/j.ijbiomac.2025.142012]

5. Ming Li, Ru Qu, Ping Li, Xuan Mo, Juan Liu, Biao Dong, Liting Liu, Zhenjiang Zech Xu.  (2024)  Epimedium polysaccharides mitigates Porphyromonas gingivalis-exacerbated intestinal inflammation by suppressing the Th17 pathway and modulating the gut microbiota.  INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,      [PMID:39098669] [10.1016/j.ijbiomac.2024.134203]