Deoxy-Bigchap - ≥90%(HPLC) , CAS No.86303-23-3

CAS: 86303-23-3 Cat. No.: D135696 Fórmula: C₄₂H₇₅N₃O₁₅ Peso molecular: 862.06 Número CE: 635-520-2

GRADE & PURITY ≥90%(HPLC)

Synonyms

8A64ND3B39 | N,N-Bis(3-(D-gluconamido)propyl)deoxycholamide | D-Gluconamide, N,N'-((((3alpha,5beta,12alpha)-3,12-dihydroxy-24-oxocholan-24-yl)imino)di-3,1-propanediyl)bis- | Deoxy-bigchap [MI] | 1imx | DB01890 | HY-W250173 | N,N'-((((3alpha,5beta,12alpha)

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Visão geral

Deoxy-Bigchap is a nonionic detergent with properties comparable to CHAPS and CHAPSO but with reduced electrostatic interactions. Suited for ion exchange chromatography.
Usually used for membrane solubilisation and proteomic analysis.

Specifications

Sinónimos

8A64ND3B39 | N,N-Bis(3-(D-gluconamido)propyl)deoxycholamide | D-Gluconamide, N,N'-((((3alpha,5beta,12alpha)-3,12-dihydroxy-24-oxocholan-24-yl)imino)di-3,1-propanediyl)bis- | Deoxy-bigchap [MI] | 1imx | DB01890 | HY-W250173 | N,N'-((((3alpha,5beta,12alpha)

Especificações e pureza

≥90%(HPLC)

Mecanismos bioquímicos e fisiológicos

N,N-Bis[3-(D-gluconamido)propyl]deoxycholamide (deoxy-BigCHAP) is a non-ionic detergent that solubilizes cell membrane.

Condições de armazenamento de armazenamento

Store at -20°C,Argon charged

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥90%(HPLC)

Nomes e identificadores

• Pubchem Sid: 504758854
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504758854
• Sorrisos canónicos: CC(CCC(=O)N(CCCNC(=O)C(C(C(C(CO)O)O)O)O)CCCNC(=O)C(C(C(C(CO)O)O)O)O)C1CCC2C1(C(CC3C2CCC4C3(CCC(C4)O)C)O)C
• IUPAC Name: (2R,3S,4R,5R)-N-[3-[[(4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]-[3-[[(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoyl]amino]propyl]amino]propyl]-2,3,4,5,6-pentahydroxyhexanamide
• InChIKey: OJSUWTDDXLCUFR-HGZMBBKESA-N
• INCHI: 1S/C42H75N3O15/c1-22(26-9-10-27-25-8-7-23-18-24(48)12-13-41(23,2)28(25)19-31(51)42(26,27)3)6-11-32(52)45(16-4-14-43-39(59)37(57)35(55)33(53)29(49)20-46)17-5-15-44-40(60)38(58)36(56)34(54)30(50)21-47/h22-31,33-38,46-51,53-58H,4-21H2,1-3H3,(H,43,59)(H,44,60)/t22-,23-,24-,25+,26-,27+,28+,29-,30-,31+,33-,34-,35+,36+,37-,38-,41+,42-/m1/s1
• SMILES isoméricas: C[C@H](CCC(=O)N(CCCNC(=O)[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)CCCNC(=O)[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C
• WGK Alemanha: 3
• Peso molecular: 862.06
• Reaxy-Rn: 59175110
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=59175110&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Steroids and steroid derivatives
      • Subclass Bile acids, alcohols and derivatives
        • Level5 Hydroxy bile acids, alcohols and derivatives
          • Level6 Dihydroxy bile acids, alcohols and derivatives

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Steroids and steroid derivatives
• Subclass: Bile acids, alcohols and derivatives
• Intermediate Tree Nodes: Hydroxy bile acids, alcohols and derivatives
• Direct Parent: Dihydroxy bile acids, alcohols and derivatives
• Alternative Parents: 3-alpha-hydroxysteroids 12-hydroxysteroids N-acyl amines Monosaccharides Tertiary carboxylic acid amides Secondary carboxylic acid amides Secondary alcohols Cyclic alcohols and derivatives Polyols Primary alcohols Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic homopolycyclic compounds
• Substituents: Dihydroxy bile acid, alcohol, or derivatives - 3-hydroxysteroid - 12-hydroxysteroid - Hydroxysteroid - 3-alpha-hydroxysteroid - Fatty amide - Fatty acyl - Monosaccharide - N-acyl-amine - Cyclic alcohol - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Carboxamide group - Secondary alcohol - Polyol - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Primary alcohol - Aliphatic homopolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as dihydroxy bile acids, alcohols and derivatives. These are compounds containing or derived from a bile acid or alcohol, and which bears exactly two carboxylic acid groups.
• 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

Propriedades químicas e físicas

• Solubilidade: Soluble in DMSO, methanol, and water.
• Sensibilidade: Hygroscopic
• Peso molecular: 862.100 g/mol
• XLogP3: -2.100
• Hydrogen Bond Donor Count: 14
• Hydrogen Bond Acceptor Count: 15
• Rotatable Bond Count: 22
• Exact Mass: 861.52 Da
• Monoisotopic Mass: 861.52 Da
• Topological Polar Surface Area: 321.000 Ų
• Heavy Atom Count: 60
• Formal Charge: 0
• Complexity: 1350.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 18
• 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