Wikstrotoxin C

Base Information

• Chemical Name: Wikstrotoxin C
• CAS No.: 88497-80-7
• Molecular Formula: C38H52 O11
• Molecular Weight: 684.8129
• Wikidata: Q110186774

Synonyms:Wikstrotoxin C;88497-80-7

Chemical Property of Wikstrotoxin C

Chemical Property:

• Vapor Pressure: 2.43E-26mmHg at 25°C
• Boiling Point: 755.4°Cat760mmHg
• PKA: 13.25±0.70(Predicted)
• Flash Point: 227.7°C
• Density: 1.29g/cm³
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 14
• Exact Mass: 684.35096247
• Heavy Atom Count: 49
• Complexity: 1490

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCC=CC=CC12OC3C4C5C(O5)(C6C7(C(C4(O1)C(C(C3(O2)C(=C)C)OC(=O)C)C)C=C(C7=O)C)OC(O6)(C)O)CO
• Isomeric SMILES: CCCCCCCCC/C=C/C=C/[C@@]12O[C@@H]3[C@@H]4[C@H]5[C@](O5)([C@@H]6C7([C@H](C4(O1)[C@@H]([C@H]([C@@]3(O2)C(=C)C)OC(=O)C)C)C=C(C7=O)C)O[C@@](O6)(C)O)CO

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