Methyl 6-O-(N-heptylcarbamoyl)-α-D-glucopyranoside - ≥98% , CAS No.115457-83-5

CAS: 115457-83-5 Cat. No.: M124435 Molecular Weight: 335.39 Beilstein Registry Number: 3560078 EC Number: 640-547-8 PubChem CID: 2733955

GRADE & PURITY ≥98%

Synonyms

SCHEMBL60345 | Methyl 6-O-(N-heptylcarbamoyl)-alpha-D-glucopyranoside, >=97.0% (TLC) | Methyl 6-O-(N-heptylcarbamoyl)-I+/--D-glucopyranoside | 6-O-(N-HEPTYLCARBAMOYL)-METHYL-.ALPHA.-D-GLUCOPYRANOSIDE | METHYL-.ALPHA.-D-GLUCOPYRANOSIDE 6-(HEPTYLCARBAMATE)

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Overview

Methyl-6-O-(n-heptylcarboxyl)-a-D-glucopyranoside is a very mild surfactant, useful for membrane protein studies. It is a non-ionic detergent useful for solubilization of membrane-bound proteins in their native state. Easily removed by dialysis.
A very mild surfactant, useful for membrane protein studies

Specifications

Synonyms

SCHEMBL60345 | Methyl 6-O-(N-heptylcarbamoyl)-alpha-D-glucopyranoside, >=97.0% (TLC) | Methyl 6-O-(N-heptylcarbamoyl)-I+/--D-glucopyranoside | 6-O-(N-HEPTYLCARBAMOYL)-METHYL-.ALPHA.-D-GLUCOPYRANOSIDE | METHYL-.ALPHA.-D-GLUCOPYRANOSIDE 6-(HEPTYLCARBAMATE)

Specifications & Purity

≥98%

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

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

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488192455
• Canonical Smiles: CCCCCCCNC(=O)OCC1C(C(C(C(O1)OC)O)O)O
• IUPAC Name: [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methyl N-heptylcarbamate
• InChIKey: XPIVOYOQXKNYHA-RGDJUOJXSA-N
• INCHI: 1S/C15H29NO7/c1-3-4-5-6-7-8-16-15(20)22-9-10-11(17)12(18)13(19)14(21-2)23-10/h10-14,17-19H,3-9H2,1-2H3,(H,16,20)/t10-,11-,12+,13-,14+/m1/s1
• Isomeric SMILES: CCCCCCCNC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC)O)O)O
• WGK Germany: 3
• PubChem CID: 2733955
• Molecular Weight: 335.39
• Beilstein: 3560078

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: Oxanes Monosaccharides Carbamate esters Secondary alcohols Organic carbonic acids and derivatives Polyols Oxacyclic compounds Acetals Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: O-glycosyl compound - Monosaccharide - Oxane - Carbamic acid ester - Carbonic acid derivative - Secondary alcohol - Acetal - Polyol - Oxacycle - Organoheterocyclic compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Carbonyl group - 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

• Sensitivity: Moisture sensitive
• Specific Rotation[α]: +101°(c=1 in water)
• Melt Point(°C): 100°C
• Molecular Weight: 335.390 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 10
• Exact Mass: 335.194 Da
• Monoisotopic Mass: 335.194 Da
• Topological Polar Surface Area: 117.000 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 342.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 5
• 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