Chemical Property of Bruceantinoside A
Chemical Property:
- Vapor Pressure:0mmHg at 25°C
- Boiling Point:898.4°C at 760 mmHg
- Flash Point:280.4°C
- PSA：245.04000
- Density:1.5g/cm3
- LogP:-1.73250
- XLogP3:0.9
- Hydrogen Bond Donor Count:6
- Hydrogen Bond Acceptor Count:16
- Rotatable Bond Count:9
- Exact Mass:710.27858538
- Heavy Atom Count:50
- Complexity:1490
- Purity/Quality:
-
99%, *data from raw suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CC1C2CC3C45COC(C4C(C(=O)O3)OC(=O)C=C(C)C(C)C)(C(C(C5C2(C=C(C1=O)OC6C(C(C(C(O6)CO)O)O)O)C)O)O)C(=O)OC
- Isomeric SMILES:C[C@H]1[C@@H]2C[C@@H]3[C@@]45COC([C@@H]4[C@H](C(=O)O3)OC(=O)/C=C(\C)/C(C)C)([C@H]([C@@H]([C@@H]5[C@]2(C=C(C1=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)O)O)C(=O)OC
