Ziconotide

Base Information

• Chemical Name: Ziconotide
• CAS No.: 107452-89-1
• Deprecated CAS: 150770-63-1,148979-96-8,148979-97-9
• Molecular Formula: C102H172N36O32S7
• Molecular Weight: 2639.13
• European Community (EC) Number: 686-412-7
• UNII: 7I64C51O16
• ChEMBL ID: CHEMBL4594214
• DSSTox Substance ID: DTXSID60883174
• NCI Thesaurus Code: C1475
• Pharos Ligand ID: 3DCHD6M15VCV,8QG8M23F1W4M
• RXCUI: 68503
• Wikipedia: Ziconotide
• Mol file: 107452-89-1.mol

Synonyms:CYS-LYS-GLY-LYS-GLY-ALA-LYS-CYS-SER-ARG-LEU-MET-TYR-ASP-CYS-CYS-THR-GLY-SER-CYS-ARG-SER-GLY-LYS-CYS-NH2;leconotide;omega-conopeptide MVIIA;omega-conotoxin M VIIA;omega-conotoxin MVIIA;omega-conotoxin MVIIA, Conus magus;Prialt;SNX 111;SNX-111;ziconotide

Chemical Property of Ziconotide

Chemical Property:

• Appearance/Colour: white powder
• PSA: 1310.94000
• Density: 1.60±0.1 g/cm3(Predicted)
• LogP: -1.73800
• Storage Temp.: −20°C
• XLogP3: -14
• Hydrogen Bond Donor Count: 42
• Hydrogen Bond Acceptor Count: 46
• Rotatable Bond Count: 40
• Exact Mass: 2638.1016905
• Heavy Atom Count: 177
• Complexity: 5480

Purity/Quality:

98% ^*data from raw suppliers

ZiconotidePolyacetate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(=O)NC(C(=O)NC2CSSCC3C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(CSSCC(C(=O)NC(CSSCC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NCC(=O)N1)CCCCN)CCCCN)N)C(=O)NC(C(=O)NCC(=O)NC(C(=O)N3)CO)C(C)O)NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC2=O)CO)CCCNC(=N)N)CC(C)C)CCSC)CC4=CC=C(C=C4)O)CC(=O)O)C(=O)N)CCCCN)CO)CCCNC(=N)N)CCCCN
• Isomeric SMILES: C[C@H]1C(=O)N[C@H](C(=O)N[C@H]2CSSC[C@H]3C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N1)CCCCN)CCCCN)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N3)CO)[C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)CO)CCCNC(=N)N)CC(C)C)CCSC)CC4=CC=C(C=C4)O)CC(=O)O)C(=O)N)CCCCN)CO)CCCNC(=N)N)CCCCN
• Recent ClinicalTrials: OP2C : Prialt? Observatory in Clinical Practice
• Recent EU Clinical Trials: Evaluation of a Structured Algorithm for Intrathecal Bolus Doses of Ziconotide(Prialt?) - The Swedish Ziconotide Bolus Study
• Uses: Ligand for binding studies of voltage sensitive calcium channels. Ziconotide, the peptide toxin of the Conus magus (cone snail) is a selective antagonist of N-type voltage sensitive calcium channels (VSCC). Blocks neurotransmitter release by preventing depolarization-induced calcium influx. Used as a ligand for binding studies of voltage sensitive calcium channels. Analgesic; neuroprotective.