KB-5246 - Moligand™ , CAS No.K611317

CAS: K611317 Cat. No.: K611317 PubChem CID: 197272

GRADE & PURITY Moligand™

Synonyms

KB5246;LS-99630

Storage

Room temperature

Specifications

Synonyme

KB5246;LS-99630

Spezifikationen & Reinheit

Moligand™

Storage

Room temperature

Note

Moligand™

Aktionsart

INHIBITOR

Namen und Kennungen

• Kanonisches Lächeln: CN1CCN(CC1)C1=C2OCC3=NSC4=C(C(=O)CC(=C1F)C4C23)C(=O)O
• InChIKey: BVTDWOWPDCPIOM-UHFFFAOYSA-N
• INCHI: 1S/C18H18FN3O4S/c1-21-2-4-22(5-3-21)15-14(19)8-6-10(23)13(18(24)25)17-11(8)12-9(20-27-17)7-26-16(12)15/h11-12H,2-7H2,1H3,(H,24,25)
• Isomere SMILES: CN1CCN(CC1)C2=C3C4C5C(=C2F)CC(=O)C(=C5SN=C4CO3)C(=O)O
• PubChem CID: 197272

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Naphthofurans

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Naphthofurans
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthofurans
• Alternative Parents: N-methylpiperazines Cyclohexenones 1,2-thiazines Tetrahydrofurans Trialkylamines Amino acids Vinyl fluorides Oxacyclic compounds Monocarboxylic acids and derivatives Fluoroalkenes Enamines Carboxylic acids Azacyclic compounds Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Naphthofuran - Cyclohexenone - N-alkylpiperazine - N-methylpiperazine - Piperazine - 1,4-diazinane - Ortho-thiazine - Tetrahydrofuran - Amino acid - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Ketone - Amino acid or derivatives - Oxacycle - Azacycle - Fluoroalkene - Haloalkene - Vinyl halide - Vinyl fluoride - Monocarboxylic acid or derivatives - Enamine - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Carbonyl group - Amine - Aliphatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as naphthofurans. These are compounds containing a furan ring fused to a naphthalene moiety. Furan is a 5 membered- ring aromatic ring with four carbon and one oxygen atoms. Naphthalene is a polycyclic aromatic hydrocarbon made up of two fused benzene rings.
• 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

Häufig gestellte Fragen

What are the CAS number, molecular formula and molecular weight?

The CAS Number is K611317. InChIKey BVTDWOWPDCPIOM-UHFFFAOYSA-N.

What is Moligand??

Moligand? is one of Aladdin Scientific's premium product lines, formulated for high-purity applications across multiple workflows. Compared to standard grades in the same workflow, Moligand? products typically offer tighter specifications, more rigorous QC, and stronger lot-to-lot consistency.

How should this product be stored?

Store at room temperature.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.