HHQ - ≥98%(HPLC) , CAS No.40522-46-1

CAS: 40522-46-1 Cat. No.: H170188 Summenformel: C₁₆H₂₁NO Molekulargewicht: 243.34 EG-Nummer: 895-787-8

GRADE & PURITY ≥98%(HPLC)

Synonyms

2-heptylquinolin-4(1H)-one|40522-46-1|2-heptyl-4-quinolone|2503-80-2|2-heptyl-1H-quinolin-4-one|2-heptyl-4(1H)-quinolone|2-Heptyl-4-hydroxyquinoline|2-heptylquinolin-4-ol|TCMDC-132026|MY-12-62c|HHQ|MY 12-62c|4-hydroxy-2-heptylquinoline|CHEBI:62219|2-hepty

Storage

Store at 2-8°C

Shipped In

Wet ice

Übersicht

HHQ belongs to 2-alkyl-4-quinolone compounds, which are lipophilic and are slightly soluble in water.

Specifications

Synonyme

2-heptylquinolin-4(1H)-one | 40522-46-1 | 2-heptyl-4-quinolone | 2503-80-2 | 2-heptyl-1H-quinolin-4-one | 2-heptyl-4(1H)-quinolone | 2-Heptyl-4-hydroxyquinoline | 2-heptylquinolin-4-ol | TCMDC-132026 | MY-12-62c | HHQ | MY 12-62c | 4-hydroxy-2-heptylquinoline | CHEBI:62219 | 2-hepty

Spezifikationen & Reinheit

≥98%(HPLC)

Biochemische und physiologische Mechanismen

HHQ or 2-Heptyl-4-quinolone is a modulator of swarm motility. HHQ can be converted to PQS (Pseudomonas quinolone signal) by the PqsH protein. HHQ stimulates vesicle formation but not as much as PQS

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%(HPLC)

Namen und Kennungen

• Pubchem Sid: 528756379
• Kanonisches Lächeln: CCCCCCCC1=CC(=O)C2=CC=CC=C2N1
• IUPAC Name: 2-heptyl-1H-quinolin-4-one
• InChIKey: UYRHHBXYXSYGHA-UHFFFAOYSA-N
• INCHI: 1S/C16H21NO/c1-2-3-4-5-6-9-13-12-16(18)14-10-7-8-11-15(14)17-13/h7-8,10-12H,2-6,9H2,1H3,(H,17,18)
• Isomere SMILES: CCCCCCCC1=CC(=O)C2=CC=CC=C2N1
• WGK Deutschland: 3
• Molekulargewicht: 243.34
• Reaxy-Rn: 1529939
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1529939&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Quinolines and derivatives
      • Subclass Quinolones and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Quinolines and derivatives
• Subclass: Quinolones and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Hydroquinolones
• Alternative Parents: Hydroquinolines Pyridines and derivatives Benzenoids Vinylogous amides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Dihydroquinolone - Dihydroquinoline - Benzenoid - Pyridine - Heteroaromatic compound - Vinylogous amide - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as hydroquinolones. These are compounds containing a hydrogenated quinoline bearing a ketone group.
• External Descriptors: a tautomer

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

Zugehörige Ziele (menschlich)

SLC2A1 Tchem Glucose transporter (14755 Activities)

Discover Target: SLC2A1

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

HepG2 (196354 Activities)

Explore this target

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

A2780 (11979 Activities)

Explore this target

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

HeLa (62764 Activities)

Explore this target

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

Zugehörige Ziele (nicht menschlich)

Staphylococcus aureus (210822 Activities)

Explore this target

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

Staphylococcus epidermidis (22802 Activities)

Explore this target

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

Plasmodium falciparum (966862 Activities)

Explore this target

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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Molekulargewicht: 243.340 g/mol
• XLogP3: 4.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 243.162 Da
• Monoisotopic Mass: 243.162 Da
• Topological Polar Surface Area: 29.100 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 308.000
• 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

Referenzen

1. Yankai Wang, Biao Hong, Baozang Yin, Yuan Li, Liuwei Huang, Shuang Tan, Tiancheng Gao, Manfred F. Maitz, Junsheng Zhang, Shunli Zheng, Can Huang, Hua Qiu, Jialong Chen, Xiangyang Li.  (2025)  Engineering Antibacterial, Biocompatible, Anti-Oxidant Titanium-Based Implants Using Polyphenols-Chlorhexidine Networks for Bone Regeneration.  Advanced Healthcare Materials,      [PMID:40270268] [10.1002/adhm.202404958]