Coenzyme Q2 - Moligand™, ≥95%, 10mg/ml in Ethanol , CAS No.606-06-4

CAS: 606-06-4 Cat. No.: U1529064 분자식: C₁₉H₂₆O₄ 분자량: 318.41 Beilstein Registry Number: 2059805 PubChem CID: 5280346

GRADE & PURITY Moligand™, ≥95%, 10mg/ml in Ethanol

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

개요

Ubiquinone-10 acts as an inhibitor of the mitochondrial permeability transition pore (MPTP). This inhibitory effect can be counteracted by ubiquinone-5.

Specifications

사양 및 순도

Moligand™, ≥95%, 10mg/ml in Ethanol

보관 조건

Protected from light,Store at -20°C

배송

Ice chest + Ice pads

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등급

Moligand™

순수함

≥95%

이름과 식별자

• 정식 스마일: CC1=C(C(=O)C(=C(C1=O)OC)OC)CC=C(C)CCC=C(C)C
• IUPAC Name: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-5,6-dimethoxy-3-methylcyclohexa-2,5-diene-1,4-dione
• InChIKey: SQQWBSBBCSFQGC-JLHYYAGUSA-N
• INCHI: 1S/C19H26O4/c1-12(2)8-7-9-13(3)10-11-15-14(4)16(20)18(22-5)19(23-6)17(15)21/h8,10H,7,9,11H2,1-6H3/b13-10+
• 이성체 SMILES: CC1=C(C(=O)C(=C(C1=O)OC)OC)C/C=C(\C)/CCC=C(C)C
• WGK 독일: 3
• PubChem CID: 5280346
• 분자량: 318.41
• Beilstein: 2059805

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • 분류 Prenol lipids
      • Subclass Quinone and hydroquinone lipids
        • Level5 Prenylquinones
          • Level6 Ubiquinones

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• 분류: Prenol lipids
• Subclass: Quinone and hydroquinone lipids
• Intermediate Tree Nodes: Prenylquinones
• Direct Parent: Ubiquinones
• Alternative Parents: Monocyclic monoterpenoids P-benzoquinones Vinylogous esters Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Ubiquinone skeleton - Monoterpenoid - Monocyclic monoterpenoid - Quinone - P-benzoquinone - Vinylogous ester - Cyclic ketone - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as ubiquinones. These are coenzyme Q derivatives containing a 5, 6-dimethoxy-3-methyl(1,4-benzoquinone) moiety to which an isoprenyl group is attached at ring position 2(or 6).
• External Descriptors: ubiquinones

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

화학 및 물리적 특성

• 용해성: Soluble in acetone (50 mg/ml), and water (Partly miscible).
• 감도: light sensitive
• 굴절률: n20D1.51 (Predicted)
• 끓는점(°C): 465.78° C at 760 mmHg (Predicted)
• 녹는점(°C): 158.22° C (Predicted)
• 분자량: 318.400 g/mol
• XLogP3: 4.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 318.183 Da
• Monoisotopic Mass: 318.183 Da
• Topological Polar Surface Area: 52.600 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 611.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1