Endothelin 3 human, rat, >=97% (HPLC), powder

Base Information

• Chemical Name: Endothelin 3 human, rat, >=97% (HPLC), powder
• CAS No.: 117399-93-6
• Molecular Formula: C121H168 N26 O33 S4
• Molecular Weight: 2643.04
• DSSTox Substance ID: DTXSID30585153
• Mol file: 117399-93-6.mol

Synonyms:DTXSID30585153;PUBCHEM_16219334;Endothelin 3 human, rat, >=97.0% (HPLC);Endothelin 3 human, rat, >=97% (HPLC), powder

Chemical Property of Endothelin 3 human, rat, >=97% (HPLC), powder

Chemical Property:

• PSA: 1056.08000
• Density: 1.285±0.06 g/cm3(Predicted)
• LogP: 6.33930
• Storage Temp.: −20°C
• XLogP3: -4.3
• Hydrogen Bond Donor Count: 34
• Hydrogen Bond Acceptor Count: 41
• Rotatable Bond Count: 49
• Exact Mass: 2642.1183514
• Heavy Atom Count: 184
• Complexity: 5720

Purity/Quality:

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

EDN3 ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)C(C(=O)NC(C(C)CC)C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CC(C)C)NC(=O)C(CC3=CN=CN3)NC(=O)C4CSSCC(C(=O)NC(C(=O)NC5CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N4)CC6=CC=C(C=C6)O)CC7=CC=C(C=C7)O)C(C)C)NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC5=O)CC8=CC=CC=C8)C(C)O)CC9=CC=C(C=C9)O)CCCCN)CC(=O)O)CCCCN)CCC(=O)O)C(C)O)N
• Isomeric SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC3=CN=CN3)NC(=O)[C@@H]4CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H]5CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N4)CC6=CC=C(C=C6)O)CC7=CC=C(C=C7)O)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC5=O)CC8=CC=CC=C8)C(C)O)CC9=CC=C(C=C9)O)CCCCN)CC(=O)O)CCCCN)CCC(=O)O)C(C)O)N
• Uses: Endothelin 3 human, rat has been used for culturing neural tube explant culture, and the pharmacological study of endothelin receptors.