Dulcitol - 10mM in DMSO , CAS No.608-66-2

CAS: 608-66-2 Cat. No.: D425039 Fórmula: C₆H₁₄O₆ Peso molecular: 182.17 Beilstein Registry Number: 1721903 Número EC: 210-165-2

GRADE & PURITY 10mM in DMSO

Synonyms

D-Dulcitol | DS-6321 | Dulcitol, puriss. | NSC-1944 | CAS-608-66-2 | DTXCID9026051 | meso-galactitol | Tox21_111644_1 | AC-34851 | G0005 | galactitol | NCGC00159410-03 | WURCS=2.0/1,1,0/[h2112h]/1/ | AI3-19423 | EINECS 210-165-2 | NCGC00159410-04 | NCGC00

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Descripción general

Dulcitol is a sugar alcohol and slightly sweet tastant for human taste cells.
Dulcitol (Galactitol), a sugar alcohol derived through reduction of galatose, is studied to determine its role and mechanisms in pathologies such as cataract formation, hepatosplenomegaly and mental retardation. Galactitol is used as a substrate to identify, differentiate and characterize galactitol dehydrogenase(s).

Specifications

Sinónimos

D-Dulcitol | DS-6321 | Dulcitol, puriss. | NSC-1944 | CAS-608-66-2 | DTXCID9026051 | meso-galactitol | Tox21_111644_1 | AC-34851 | G0005 | galactitol | NCGC00159410-03 | WURCS=2.0/1,1,0/[h2112h]/1/ | AI3-19423 | EINECS 210-165-2 | NCGC00159410-04 | NCGC00

Especificaciones y pureza

10mM in DMSO

Mecanismos bioquímicos y fisiológicos

A sugar alcohol and slightly sweet tastant for human taste cells.

Condiciones de almacenamiento de almacenamiento

Store at -80°C

Enviado en

Dry ice packs + Cold packs

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Nombres e identificadores

Pubchem Sid

528770290

Sonrisas canónicas

C(C(C(C(C(CO)O)O)O)O)O

IUPAC Name

(2R,3S,4R,5S)-hexane-1,2,3,4,5,6-hexol

InChIKey

FBPFZTCFMRRESA-GUCUJZIJSA-N

INCHI

1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4+,5+,6-

Isómeros SMILES

C([C@H]([C@@H]([C@@H]([C@H](CO)O)O)O)O)O

WGK Alemania

3

Peso molecular

182.17

Beilstein

1721903

Reaxy-Rn

8496933

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8496933&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Sugar alcohols
• Alternative Parents: Monosaccharides Secondary alcohols Polyols Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Sugar alcohol - Monosaccharide - Secondary alcohol - Polyol - Hydrocarbon derivative - Primary alcohol - Alcohol - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as sugar alcohols. These are hydrogenated forms of carbohydrate in which the carbonyl group (aldehyde or ketone, reducing sugar) has been reduced to a primary or secondary hydroxyl group.
• External Descriptors: hexitol

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

Objetivos asociados (humanos)

HT-29 (80576 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

MCF7 (126967 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

NCI-H460 (60772 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Objetivos asociados (no humanos)

Galc Galactocerebrosidase (11 Activities)

Discover Target: Galc

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CHO-K1 (1115 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: Moisture sensitive
• Punto de ebullición (°C): 275～280°C
• Punto de fusión (°C): 188-189°C
• Peso molecular: 182.170 g/mol
• XLogP3: -3.100
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 182.079 Da
• Monoisotopic Mass: 182.079 Da
• Topological Polar Surface Area: 121.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 105.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• 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