Chemical Property of Vanicoside A
Chemical Property:
- Vapor Pressure:0mmHg at 25°C
- Melting Point:161-162 °C
- Boiling Point:1155.8°Cat760mmHg
- PKA:9.67±0.26(Predicted)
- Flash Point:332.6°C
- PSA：310.03000
- Density:1.51g/cm3
- LogP:3.06340
- XLogP3:4.2
- Hydrogen Bond Donor Count:7
- Hydrogen Bond Acceptor Count:21
- Rotatable Bond Count:24
- Exact Mass:998.28445860
- Heavy Atom Count:72
- Complexity:1900
- Purity/Quality:
-
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CC(=O)OC1C(C(C(OC1OC2(C(C(C(O2)COC(=O)C=CC3=CC=C(C=C3)O)O)OC(=O)C=CC4=CC=C(C=C4)O)COC(=O)C=CC5=CC=C(C=C5)O)COC(=O)C=CC6=CC(=C(C=C6)O)OC)O)O
- Isomeric SMILES:CC(=O)O[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1O[C@@]2([C@H]([C@@H]([C@H](O2)COC(=O)/C=C/C3=CC=C(C=C3)O)O)OC(=O)/C=C/C4=CC=C(C=C4)O)COC(=O)/C=C/C5=CC=C(C=C5)O)COC(=O)/C=C/C6=CC(=C(C=C6)O)OC)O)O
