CID 6917949

Base Information

• Chemical Name: CID 6917949
• CAS No.: 512-64-1
• Molecular Formula: C51H64 N12 O12 S2
• Molecular Weight: 1101.27
• Hs Code.: 2941900000
• European Community (EC) Number: 637-095-9
• Wikipedia: Echinomycin
• NCI Thesaurus Code: C462
• Mol file: 512-64-1.mol

Synonyms:Echinomycin;NSC 526417;NSC-526417;NSC526417;Quinomycin A

Chemical Property of CID 6917949

Chemical Property:

• Vapor Pressure: 0.184mmHg at 25°C
• Melting Point: 217-218℃
• Refractive Index: 1.536
• Boiling Point: 1427.2 ºC at 760 mmHg
• Flash Point: 817 ºC
• PSA: 352.40000
• Density: 1.41 g/cm³
• LogP: 1.82630
• Storage Temp.: 2-8°C
• Solubility.: Soluble in DMSO (up to 5 mg/ml)
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 18
• Rotatable Bond Count: 7
• Exact Mass: 1100.42080787
• Heavy Atom Count: 77
• Complexity: 2200

Purity/Quality:

98%,99%, ^*data from raw suppliers

Quinomycin A ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 46-23/24/25
• Safety Statements: 53-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(=O)N(C2CSC(C(C(=O)N(C(C(=O)OCC(C(=O)N1)NC(=O)C3=NC4=CC=CC=C4N=C3)C(C)C)C)N(C(=O)C(NC(=O)C(COC(=O)C(N(C2=O)C)C(C)C)NC(=O)C5=NC6=CC=CC=C6N=C5)C)C)SC)C
• Isomeric SMILES: C[C@H]1C(=O)N([C@@H]2CSC([C@@H](C(=O)N([C@H](C(=O)OC[C@H](C(=O)N1)NC(=O)C3=NC4=CC=CC=C4N=C3)C(C)C)C)N(C(=O)[C@@H](NC(=O)[C@@H](COC(=O)[C@@H](N(C2=O)C)C(C)C)NC(=O)C5=NC6=CC=CC=C6N=C5)C)C)SC)C
• Description: Hypoxia-inducible factor-1 (HIF-1) is a transcription factor that controls genes involved in glycolysis, angiogenesis, migration, and invasion. Echinomycin is a cell-permeable inhibitor of HIF-1-mediated gene transcription. It acts by intercalating into DNA in a sequence-specific manner, blocking the binding of either HIF-1α or HIF-1β to the hypoxia-responsive element. Echinomycin reversibly inhibits hypoxia-induced HIF-1 transcription activity in U215 cells with an EC50 value of 1.2 nM. It inhibits hypoxia-induced expression of vascular endothelial growth factor, blocking angiogenesis and altering excitatory synaptic transmission in hippocampal neurons. Echinomycin also impairs expression of survivin, enhancing the sensitivity of multiple myeloma cells to melphalan.
• Uses: Quiniomycin A is a cyclic depsipeptide metabolite. Quinomycin A has broad activity against bacteria, fungi and viruses, and has found application as an antitumour agent. Quinomycin A acts by bifunctional intercalation of nucleic acids. Recent research has shown quinomycin A to be an extremely potent inhibitor of hypoxia-inducible factor-1 (HIF-1). This transcription factor plays an essential role in tumour progression and metastasis. Quinomycin A is a cyclic depsipeptide metabolite. Quinomycin A has broad activity against bacteria, fungi and viruses, and has found application as an antitumor agent. Quinomycin A acts by bifunctional intercalation of nucleic acids. Recent research has shown quinomycin A to be an extremely potent inhibitor of hypoxia-inducible factor-1 (HIF-1). This transcription factor plays an essential role in tumor progression and metastasis. Echinomycin has been used for inhibition of hypoxia-inducible factor 1.