Record No. 1 of 6

ID2156
NameFagaridine
Pubchem ID177893
KEGG IDC09430
SourceMacleaya cordata
TypeNatural
FunctionAntimalarial
Drug Like PropertiesYes
Molecular Weight334.35
Exact mass334.107933
Molecular formulaC20H16NO4+
XlogP4.3
Topological Polar Surface Area51.8
H-Bond Donor1
H-Bond Acceptor4
Rotational Bond Count1
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC[N+]1=C2C(=C3C=CC(=C(C3=C1)O)OC)C=CC4=CC5=C(C=C42)OCO5
Isomeric SMILEN/A
Drugpediawiki
References1. Tolkachev,Pharm.Chem.J.,33,(1999),86
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 2 of 6

ID2572
NameMacarpine
Pubchem ID440929
KEGG IDC06165
SourceMacleaya cordata
TypeNatural
FunctionUnknown
Drug Like PropertiesYes
Molecular Weight392.38
Exact mass392.113412
Molecular formulaC22H18NO6+
XlogP4.4
Topological Polar Surface Area59.3
H-Bond Donor0
H-Bond Acceptor6
Rotational Bond Count2
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC[N+]1=CC2=C3C(=CC(=C2C4=C1C5=CC6=C(C=C5C(=C4)OC)OCO6)OC)OCO3
Isomeric SMILEN/A
Drugpediawiki
References1. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
2. Source  
3. Function  
4. All Records  
Record No. 3 of 6

ID3139
NameSanguinarine
Pubchem ID5154
KEGG IDC06162
SourceMacleaya cordata
TypeNatural
FunctionAnti-inflammatory
Drug Like PropertiesYes
Molecular Weight332.33
Exact mass332.092283
Molecular formulaC20H14NO4+
XlogP4.4
Topological Polar Surface Area40.8
H-Bond Donor0
H-Bond Acceptor4
Rotational Bond Count0
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC[N+]1=C2C(=C3C=CC4=C(C3=C1)OCO4)C=CC5=CC6=C(C=C52)OCO6
Isomeric SMILEN/A
Drugpediawiki
References1. Tolkachev,Pharm.Chem.J.,33,(1999),86
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 4 of 6

ID3153
NameSanguinarine
Pubchem ID5154
KEGG IDC06162
SourceMacleaya cordata
TypeNatural
FunctionGlutamate decarboxylase inhibitor
Drug Like PropertiesYes
Molecular Weight332.33
Exact mass332.092283
Molecular formulaC20H14NO4+
XlogP4.4
Topological Polar Surface Area40.8
H-Bond Donor0
H-Bond Acceptor4
Rotational Bond Count0
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC[N+]1=C2C(=C3C=CC4=C(C3=C1)OCO4)C=CC5=CC6=C(C=C52)OCO6
Isomeric SMILEN/A
Drugpediawiki
References1. Tolkachev,Pharm.Chem.J.,33,(1999),86
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 5 of 6

ID3167
NameSanguinarine
Pubchem ID5154
KEGG IDC06162
SourceMacleaya cordata
TypeNatural
FunctionAntibacterial
Drug Like PropertiesYes
Molecular Weight332.33
Exact mass332.092283
Molecular formulaC20H14NO4+
XlogP4.4
Topological Polar Surface Area40.8
H-Bond Donor0
H-Bond Acceptor4
Rotational Bond Count0
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC[N+]1=C2C(=C3C=CC4=C(C3=C1)OCO4)C=CC5=CC6=C(C=C52)OCO6
Isomeric SMILEN/A
Drugpediawiki
References1. Tolkachev,Pharm.Chem.J.,33,(1999),86
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 6 of 6

ID3181
NameSanguinarine
Pubchem ID5154
KEGG IDC06162
SourceMacleaya cordata
TypeNatural
FunctionCytotoxic
Drug Like PropertiesYes
Molecular Weight332.33
Exact mass332.092283
Molecular formulaC20H14NO4+
XlogP4.4
Topological Polar Surface Area40.8
H-Bond Donor0
H-Bond Acceptor4
Rotational Bond Count0
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC[N+]1=C2C(=C3C=CC4=C(C3=C1)OCO4)C=CC5=CC6=C(C=C52)OCO6
Isomeric SMILEN/A
Drugpediawiki
References1. Tolkachev,Pharm.Chem.J.,33,(1999),86
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records