Record No. 1 of 2

ID2776
NameNitidine
Pubchem ID4501
KEGG IDC09595
SourceZanthoxylum clava-herculis
TypeNatural
FunctionAnticancer
Drug Like PropertiesYes
Molecular Weight348.37
Exact mass348.123583
Molecular formulaC21H18NO4+
XlogP4.6
Topological Polar Surface Area40.8
H-Bond Donor0
H-Bond Acceptor4
Rotational Bond Count2
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC[N+]1=CC2=CC(=C(C=C2C3=C1C4=CC5=C(C=C4C=C3)OCO5)OC)OC
Isomeric SMILEN/A
Drugpediawiki
References1. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
2. Source  
3. Function  
4. All Records  
Record No. 2 of 2

ID2780
NameNitidine
Pubchem ID4501
KEGG IDC09595
SourceZanthoxylum clava-herculis
TypeNatural
FunctionToxic
Drug Like PropertiesYes
Molecular Weight348.37
Exact mass348.123583
Molecular formulaC21H18NO4+
XlogP4.6
Topological Polar Surface Area40.8
H-Bond Donor0
H-Bond Acceptor4
Rotational Bond Count2
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC[N+]1=CC2=CC(=C(C=C2C3=C1C4=CC5=C(C=C4C=C3)OCO5)OC)OC
Isomeric SMILEN/A
Drugpediawiki
References1. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
2. Source  
3. Function  
4. All Records