P6949 - Moligand™ , Inhibitor of phosphatase and tensin homolog, CAS No.P612601, Inhibitor of phosphatase and tensin homolog

CAS: P612601 Cat. No.: P612601 PubChem CID: 24204784

GRADE & PURITY Moligand™

Storage

Room temperature

Specifications

Specifications & Purity

Moligand™

Storage

Room temperature

Grade

Moligand™

Action Type

INHIBITOR

Mechanism of action

Inhibitor of phosphatase and tensin homolog

Names and Identifiers

• Canonical Smiles: OC(=O)CCc1cccc(c1)[Sb](=O)(O)O
• IUPAC Name: 3-(3-stibonophenyl)propanoic acid
• InChIKey: VXMRXQJADBGVFN-UHFFFAOYSA-L
• INCHI: 1S/C9H9O2.2H2O.O.Sb/c10-9(11)7-6-8-4-2-1-3-5-8;;;;/h1-2,4-5H,6-7H2,(H,10,11);2*1H2;;/q;;;;+2/p-2
• Isomeric SMILES: C1=CC(=CC(=C1)[Sb](=O)(O)O)CCC(=O)O
• PubChem CID: 24204784

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Phenylpropanoids and polyketides
    • Class Phenylpropanoic acids

• Kingdom: Organic compounds
• Superclass: Phenylpropanoids and polyketides
• Class: Phenylpropanoic acids
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylpropanoic acids
• Alternative Parents: Metal aryls Benzene and substituted derivatives Organic antimony salts Monocarboxylic acids and derivatives Carboxylic acids Organoantimony compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: 3-phenylpropanoic-acid - Monocyclic benzene moiety - Metal aryl - Benzenoid - Organic antimony salt - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic metalloid salt - Organic metal salt - Organometallic compound - Organoantimony compound - Organic metalloid moeity - Carbonyl group - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as phenylpropanoic acids. These are compounds with a structure containing a benzene ring conjugated to a propanoic acid.
• 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

Associated Targets(Human)

PTEN Tchem Phosphatidylinositol 3,4,5-trisphosphate 3-phosphatase and dual-specificity protein phosphatase PTEN (1 Activities)

Discover Target: PTEN

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)