Questiomycine A - Moligand™, ≥98% , CAS No.1916-59-2

CAS: 1916-59-2 Cat. No.: Q329462 Formule: C₁₂H₈N₂O₂ Poids moléculaire: 212.20 Numéro CE: 690-502-1

GRADE & PURITY Moligand™, ≥98%

Synonyms

DTXSID60172691 | 2-acetylamino-(3h)-phenoxazin-3-one | 2-aminophenoxazine-3-one | 3H-Phenoxazin-3-one,2-amino- | Acrospermumviticola toxin C | Dibenzo(b,h)pyrene | BRN 0014215 | F11662 | NCIOpen2_006212 | 3-Aminophenoxazone | J-012388 | METHYLENECYCLOHEXA

Storage

Conserver à -20°C

Shipped In

Glacière + blocs de glace

Vue d’ensemble

La questiomycine A est une phénoxazine produite par plusieurs espèces de Streptomyces et par certains champignons et bactéries. La questiomycine A est faiblement active contre les bactéries, les champignons, les plantes et les lignées cellulaires tumorales, et inhibe l'aromatase et les sulfatases. La questiomycine, comme d'autres phénoxazines, stimule la croissance et le renouvellement des cellules in vitro, une activité probablement liée à leur capacité à former des radicaux libres stables. Plus récemment, il a été démontré que la questiomycine A inhibe les métastases pulmonaires causées par des cellules de mélanome de souris. La questiomycine A et les phénoxazines apparentées sont des normes de déréplication importantes dans la recherche de découverte afin d'éliminer les pistes dues à des quantités élevées d'actifs faiblement puissants.

Specifications

Synonymes

DTXSID60172691 | 2-acetylamino-(3h)-phenoxazin-3-one | 2-aminophenoxazine-3-one | 3H-Phenoxazin-3-one,2-amino- | Acrospermumviticola toxin C | Dibenzo(b,h)pyrene | BRN 0014215 | F11662 | NCIOpen2_006212 | 3-Aminophenoxazone | J-012388 | METHYLENECYCLOHEXA

Spécifications et pureté

Moligand™, ≥98%

Mécanismes biochimiques et physiologiques

La questiomycine A (Phx-3) est un dégradeur du GRP78 (chaperon cytoprotecteur du réticulum endoplasmique) et renforce l'activité anticancéreuse du Sorafenib. La questiomycine A est également un antimicrobien/antibiotique qui peut être obtenu à partir du m

Conditions de stockage de stockage

Conserver à -20°C

Expédié en

Glacière + blocs de glace

Grade

Moligand™

Pureté

≥98%

Propriétés du produit

• pKa: pKₐ: 2.73 (Predicted)

Noms et identifiants

• Pubchem Sid: 528766832
• Sourires canoniques: C1=CC=C2C(=C1)N=C3C=C(C(=O)C=C3O2)N
• IUPAC Name: 2-aminophenoxazin-3-one
• InChIKey: RDJXPXHQENRCNG-UHFFFAOYSA-N
• INCHI: 1S/C12H8N2O2/c13-7-5-9-12(6-10(7)15)16-11-4-2-1-3-8(11)14-9/h1-6H,13H2
• Isomères SMILES: C1=CC=C2C(=C1)N=C3C=C(C(=O)C=C3O2)N
• RTECS: SP76950000
• Poids moléculaire: 212.20

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Benzoxazines
      • Subclass Phenoxazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Benzoxazines
• Subclass: Phenoxazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenoxazines
• Alternative Parents: Benzenoids Heteroaromatic compounds Cyclic ketones Oxacyclic compounds Azacyclic compounds Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Phenoxazine - Benzenoid - Heteroaromatic compound - Cyclic ketone - Azacycle - Oxacycle - Amine - Organopnictogen compound - Organic oxygen compound - Primary amine - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as phenoxazines. These are polycyclic aromatic compounds containing a phenoxazine moiety, which is a linear tricyclic system that consists of a two benzene rings joined by a 1,4-oxazine ring.
• External Descriptors: a small molecule

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

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Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Soluble in ethanol, methanol, DMF and DMSO. Limited water solubility.
• Indice de réfraction: n20D1.72 (Predicted)
• Point d'ébullition (°C): ~362.0° C at 760 mmHg (Predicted)
• Point de fusion (°C): 144.37° C (Predicted)
• Poids moléculaire: 212.200 g/mol
• XLogP3: 1.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 212.059 Da
• Monoisotopic Mass: 212.059 Da
• Topological Polar Surface Area: 64.700 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 434.000
• 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