Chemical Property of CID 5487770
Chemical Property:
- PSA：233.65000
- LogP:-1.49510
- XLogP3:0.3
- Hydrogen Bond Donor Count:7
- Hydrogen Bond Acceptor Count:14
- Rotatable Bond Count:8
- Exact Mass:535.10878040
- Heavy Atom Count:38
- Complexity:1020
- Purity/Quality:
-
99%, *data from raw suppliers
Apigenin7-O-(6''-O-malonylglucoside) *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:C1=CC(=C[CH]C1C2=C(C(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)OC(=O)CC(=O)O)O
- Isomeric SMILES:C1=CC(=C[CH]C1C2=C(C(=O)C3=C(C=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)OC(=O)CC(=O)O)O
