Galactinol Hydrate - ≥99%(HPLC) , CAS No.3687-64-7

CAS: 3687-64-7 Cat. No.: G156792 Molecular Weight: 342.30(Anhydrous) Beilstein Registry Number: 17(3/4)3008

GRADE & PURITY ≥99%(HPLC)

Synonyms

Galactinol | 1-alpha-D-Galactosyl-myo-inositol | O-alpha-D-galactosyl-(1->3)-1D-myo-inositol | GALACTINOL HYDRATE | WZE56L8UKR | 3-O-alpha-D-Galactosyl-1D-myo-inositol | alpha-D-galactosyl-(1->3)-1D-myo-inositol | 1-O-alpha-D-Galactosyl-D-myo-inositol | C

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

Galactinol | 1-alpha-D-Galactosyl-myo-inositol | O-alpha-D-galactosyl-(1->3)-1D-myo-inositol | GALACTINOL HYDRATE | WZE56L8UKR | 3-O-alpha-D-Galactosyl-1D-myo-inositol | alpha-D-galactosyl-(1->3)-1D-myo-inositol | 1-O-alpha-D-Galactosyl-D-myo-inositol | C

Specifications & Purity

≥99%(HPLC)

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥99%(HPLC)

Names and Identifiers

• Pubchem Sid: 504766676
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504766676
• Canonical Smiles: C(C1C(C(C(C(O1)OC2C(C(C(C(C2O)O)O)O)O)O)O)O)O
• IUPAC Name: (1S,2R,4S,5S)-6-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexane-1,2,3,4,5-pentol
• InChIKey: VCWMRQDBPZKXKG-ZNVDUFQESA-N
• INCHI: 1S/C12H22O11/c13-1-2-3(14)4(15)10(21)12(22-2)23-11-8(19)6(17)5(16)7(18)9(11)20/h2-21H,1H2/t2-,3+,4+,5?,6-,7+,8+,9+,10-,11?,12-/m1/s1
• Isomeric SMILES: C([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)OC2[C@H]([C@H](C([C@H]([C@@H]2O)O)O)O)O)O)O)O)O
• Molecular Weight: 342.30(Anhydrous)
• Beilstein: 17(3/4)3008
• Reaxy-Rn: 62158499
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=62158499&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates
        • Level5 Glycosyl compounds
          • Level6 O-glycosyl compounds

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Glycosyl compounds
• Direct Parent: O-glycosyl compounds
• Alternative Parents: Cyclohexanols Oxanes Monosaccharides Cyclitols and derivatives Polyols Oxacyclic compounds Acetals Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: O-glycosyl compound - Cyclohexanol - Oxane - Monosaccharide - Cyclitol or derivatives - Cyclic alcohol - Secondary alcohol - 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 o-glycosyl compounds. These are glycoside in which a sugar group is bonded through one carbon to another group via a O-glycosidic bond.
• 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

• Solubility: Soluble in water
• Sensitivity: Hygroscopic
• Specific Rotation[α]: 132° (C=1,H2O)
• Melt Point(°C): 221 °C
• Molecular Weight: 342.300 g/mol
• XLogP3: -5.300
• Hydrogen Bond Donor Count: 9
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 3
• Exact Mass: 342.116 Da
• Monoisotopic Mass: 342.116 Da
• Topological Polar Surface Area: 201.000 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 379.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 9
• Undefined Atom Stereocenter Count: 0
• 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. Feng Lijuan, Yu Shuping, Jin Weimei, Xiao Changyan, Qiao Yan, Yang Guangfeng.  (2024)  The role of hydroponic solution of Ulva fasciata in modulating the antibiotic resistance of Vibrio alginolyticus.  JOURNAL OF APPLIED MICROBIOLOGY,      [PMID:39533112] [10.1093/jambio/lxae281]