MS8815 - Moligand™ , von Hippel-Lindau tumor suppressor, CAS No.M612094, von Hippel-Lindau tumor suppressor

CAS: M612094 Cat. No.: M612094 PubChem CID: 165368931

GRADE & PURITY Moligand™

Synonyms

compound 16;MS-8815

Storage

Room temperature

Specifications

Synonyms

compound 16;MS-8815

Specifications & Purity

Moligand™

Storage

Room temperature

Grade

Moligand™

Mechanism of action

von Hippel-Lindau tumor suppressor

Names and Identifiers

• Canonical Smiles: Cc1c(c(=O)[nH]c(c1)C)CNC(=O)c1cc(cc(c1C)N(C1CCOCC1)CC)c1ccc(cc1)CN1CCN(CC1)C(=O)CCCCCCCC(=O)N[C@H](C(=O)N1[C@@H](C[C@H](C1)O)C(=O)NCc1ccc(cc1)c1c(ncs1)C)C(C)(C)C
• IUPAC Name: (2S,4R)-1-((S)-2-(9-(4-((3′-(((4,6-Dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)carbamoyl)-5′-(ethyl(tetrahydro-2H-pyran-4-yl)amino)-4′-methyl-[1,1′-biphenyl]-4-yl)methyl)piperazin-1-yl)-9-oxononanamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
• InChIKey: AOIZISCRIVNZJJ-XWJFFXCMSA-N
• INCHI: 1S/C65H87N9O8S/c1-9-73(51-25-31-82-32-26-51)55-35-50(34-53(44(55)4)61(78)67-38-54-42(2)33-43(3)69-62(54)79)48-21-19-47(20-22-48)39-71-27-29-72(30-28-71)58(77)16-14-12-10-11-13-15-57(76)70-60(65(6,7)8)64(81)74-40-52(75)36-56(74)63(80)66-37-46-17-23-49(24-18-46)59-45(5)68-41-83-59/h17-24,33-35,41,51-52,56,60,75H,9-16,25-32,36-40H2,1-8H3,(H,66,80)(H,67,78)(H,69,79)(H,70,76)/t52-,56+,60-/m1/s1
• PubChem CID: 165368931

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Peptides
          • Level6 Dipeptides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Peptides
• Direct Parent: Dipeptides
• Alternative Parents: Valine and derivatives Proline and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Aminobenzamides Benzamides Pyrrolidinecarboxamides Polyhalopyridines Phenylmethylamines N-acylpyrrolidines Dialkylarylamines Benzylamines Benzoyl derivatives Aniline and substituted anilines Pyridinones N-alkylpiperazines Methylpyridines Hydroxypyridines Dihydropyridines Aralkylamines 2-halopyridines Oxanes N-acyl amines Thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Secondary alcohols Lactams Imidothioesters Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Imidothioic acids and derivatives Enamines Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alpha-dipeptide - Valine or derivatives - Proline or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Aminobenzoic acid or derivatives - Aminobenzamide - Alpha-amino acid or derivatives - Benzoic acid or derivatives - Benzamide - Polyhalopyridine - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - Phenylmethylamine - N-acylpyrrolidine - Benzylamine - Benzoyl - 2-halopyridine - Methylpyridine - Hydroxypyridine - Aralkylamine - N-alkylpiperazine - Pyridinone - Dihydropyridine - Fatty acyl - Benzenoid - Pyridine - Piperazine - Oxane - N-acyl-amine - Fatty amide - 1,4-diazinane - Monocyclic benzene moiety - Heteroaromatic compound - Thiazole - Tertiary carboxylic acid amide - Pyrrolidine - Azole - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - Lactam - Imidothioester - Carboxamide group - Amino acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Imidothioic acid or derivatives - Ether - Enamine - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
• 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)

VHL Tchem von Hippel-Lindau disease tumor suppressor (0 Activities)

Discover Target: VHL

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