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):
- Hazard Codes:
- 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