scyllo-Inositol - Moligand™, 10mM in Water , CAS No.488-59-5

CAS: 488-59-5 Cat. No.: S424231 Formule: C₆H₁₂O₆ Poids moléculaire: 180.16 Beilstein Registry Number: 6(4)7920 Numéro CE: 610-437-4

GRADE & PURITY Moligand™, 10mM in Water

Synonyms

inositol|myo-inositol|Scyllo-inositol|epi-Inositol|Muco-Inositol|Allo-inositol|i-Inositol|87-89-8|meso-Inositol|Neo-inositol|1L-Chiro-inositol|D-(+)-chiro-Inositol|cis-Inositol|643-12-9|488-59-5|1D-Chiro-inositol|D-chiro-Inositol|Myoinositol|Scyllitol|691

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Vue d’ensemble

scyllo-Inositol is one of the eight naturally occurring isomers of inositol. scyllo-Inositol can be detected using NMR at a peak at 3.35 ppm in the 1H-NMR spectrum, and a peak at 74.5 ppm in the 13C-NMR spectrum. Certain enzymes have been shown to interconvert myo- and scyllo-Inositol while at the same to producing neo-Inositol.
A naturally occurring isomer of myo-inositol

Specifications

Synonymes

inositol | myo-inositol | Scyllo-inositol | epi-Inositol | Muco-Inositol | Allo-inositol | i-Inositol | 87-89-8 | meso-Inositol | Neo-inositol | 1L-Chiro-inositol | D-(+)-chiro-Inositol | cis-Inositol | 643-12-9 | 488-59-5 | 1D-Chiro-inositol | D-chiro-Inositol | Myoinositol | Scyllitol | 691

Spécifications et pureté

Moligand™, 10mM in Water

Mécanismes biochimiques et physiologiques

Endogenous inositol isomer. Inhibits amyloid β peptide aggregation in vivo . Readily crosses the blood-brain barrier.

Conditions de stockage de stockage

Store at -80°C

Expédié en

Dry ice packs + Cold packs

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Grade

Moligand™

Noms et identifiants

Pubchem Sid

528776408

Sourires canoniques

C1(C(C(C(C(C1O)O)O)O)O)O

IUPAC Name

cyclohexane-1,2,3,4,5,6-hexol

InChIKey

CDAISMWEOUEBRE-UHFFFAOYSA-N

INCHI

1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H

Isomères SMILES

C1(C(C(C(C(C1O)O)O)O)O)O

WGK Allemagne

3

Poids moléculaire

180.16

Beilstein

6(4)7920

Reaxy-Rn

1907328

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1907328&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Alcohols and polyols
        • Level5 Secondary alcohols
          • Level6 Cyclohexanols

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Secondary alcohols
• Direct Parent: Cyclohexanols
• Alternative Parents: Sugar alcohols Cyclitols and derivatives Polyols Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclohexanol - Sugar alcohol - Cyclitol or derivatives - Cyclic alcohol - Polyol - Hydrocarbon derivative - Aliphatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as cyclohexanols. These are compounds containing an alcohol group attached to a cyclohexane ring.
• External Descriptors: an inositol

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

Propriétés chimiques et physiques

• Point de fusion (°C): 350°C(lit.)
• Poids moléculaire: 180.160 g/mol
• XLogP3: -3.700
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 180.063 Da
• Monoisotopic Mass: 180.063 Da
• Topological Polar Surface Area: 121.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 104.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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