Record No. 1 of 5

ID2034
NameDihydrosanguinarine
Pubchem ID124069
KEGG IDC05191
SourceFumaria parviflora
TypeNatural
FunctionAnti-inflammatory
Drug Like PropertiesYes
Molecular Weight333.34
Exact mass333.100108
Molecular formulaC20H15NO4
XlogP4.1
Topological Polar Surface Area40.2
H-Bond Donor0
H-Bond Acceptor5
Rotational Bond Count0
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CC2=C(C=CC3=C2OCO3)C4=C1C5=CC6=C(C=C5C=C4)OCO6
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 5

ID2282
NameHydrastine
Pubchem ID442247
KEGG IDC09462
SourceFumaria parviflora
TypeNatural
FunctionHaemostatic
Drug Like PropertiesYes
Molecular Weight383.39
Exact mass383.136887
Molecular formulaC21H21NO6
XlogP2.7
Topological Polar Surface Area66.5
H-Bond Donor0
H-Bond Acceptor7
Rotational Bond Count3
IUPAC Name(3R)-6,7-dimethoxy-3-[(5R)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-3H-2-benzofuran-1-one
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=CC3=C(C=C2C1C4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OCO3
Isomeric SMILECN1CCC2=CC3=C(C=C2[C@@H]1[C@H]4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OCO3
Drugpediawiki
References1. Sousek,Phytochem.Anal.,10,(1999),6
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 3 of 5

ID2285
NameHydrastine
Pubchem ID442247
KEGG IDC09462
SourceFumaria parviflora
TypeNatural
FunctionAntiseptic
Drug Like PropertiesYes
Molecular Weight383.39
Exact mass383.136887
Molecular formulaC21H21NO6
XlogP2.7
Topological Polar Surface Area66.5
H-Bond Donor0
H-Bond Acceptor7
Rotational Bond Count3
IUPAC Name(3R)-6,7-dimethoxy-3-[(5R)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-3H-2-benzofuran-1-one
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=CC3=C(C=C2C1C4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OCO3
Isomeric SMILECN1CCC2=CC3=C(C=C2[C@@H]1[C@H]4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OCO3
Drugpediawiki
References1. Sousek,Phytochem.Anal.,10,(1999),6
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 4 of 5

ID2993
NameProtopine
Pubchem ID4970
KEGG IDC05189
SourceFumaria parviflora
TypeNatural
FunctionAntibacterial
Drug Like PropertiesYes
Molecular Weight353.37
Exact mass353.126323
Molecular formulaC20H19NO5
XlogP2.8
Topological Polar Surface Area57.2
H-Bond Donor0
H-Bond Acceptor6
Rotational Bond Count0
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=CC3=C(C=C2C(=O)CC4=C(C1)C5=C(C=C4)OCO5)OCO3
Isomeric SMILEN/A
Drugpediawiki
References1. Source  
2. Function  
3. All Records  
Record No. 5 of 5

ID3293
NameStylopine
Pubchem ID440583
KEGG IDC05175
SourceFumaria parviflora
TypeNatural
FunctionUnknown
Drug Like PropertiesYes
Molecular Weight323.34
Exact mass323.115758
Molecular formulaC19H17NO4
XlogP3
Topological Polar Surface Area40.2
H-Bond Donor0
H-Bond Acceptor5
Rotational Bond Count0
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC1CN2CC3=C(CC2C4=CC5=C(C=C41)OCO5)C=CC6=C3OCO6
Isomeric SMILEC1CN2CC3=C(C[C@H]2C4=CC5=C(C=C41)OCO5)C=CC6=C3OCO6
Drugpediawiki
References1. M.E.Popova,Planta Med.,45,(1982),120
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records