Record No. 1 of 5

ID1088
NameActinodaphine
Pubchem ID160502
KEGG IDC09322
SourceNeolitsea konishii
TypeNatural
FunctionAntimicrobial
Drug Like PropertiesYes
Molecular Weight311.33
Exact mass311.115758
Molecular formulaC18H17NO4
XlogP2.4
Topological Polar Surface Area60
H-Bond Donor2
H-Bond Acceptor5
Rotational Bond Count1
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1=C(C=C2CC3C4=C(C2=C1)C5=C(C=C4CCN3)OCO5)O
Isomeric SMILECOC1=C(C=C2C[C@H]3C4=C(C2=C1)C5=C(C=C4CCN3)OCO5)O
Drugpediawiki
References1. Lee,J.Chin.Chem.Soc.,39,(1992),189
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 2 of 5

ID2255
NameGlaziovine
Pubchem ID442245
KEGG IDC09457
SourceNeolitsea konishii
TypeNatural
FunctionAntidepressant
Drug Like PropertiesYes
Molecular Weight297.35
Exact mass297.136493
Molecular formulaC18H19NO3
XlogP2.2
Topological Polar Surface Area49.8
H-Bond Donor1
H-Bond Acceptor4
Rotational Bond Count1
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=CC(=C(C3=C2C1CC34C=CC(=O)C=C4)O)OC
Isomeric SMILECN1CCC2=CC(=C(C3=C2[C@H]1CC34C=CC(=O)C=C4)O)OC
Drugpediawiki
References1. Lee,J.Chin.Chem.Soc.,39,(1992),189
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 3 of 5

ID2444
NameIsoteolin
Pubchem ID133323
KEGG IDC09541
SourceNeolitsea konishii
TypeNatural
FunctionInsect feeding inhibitor
Drug Like PropertiesYes
Molecular Weight327.37
Exact mass327.147058
Molecular formulaC19H21NO4
XlogP2.2
Topological Polar Surface Area62.2
H-Bond Donor2
H-Bond Acceptor5
Rotational Bond Count2
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C43)OC)O)O)OC
Isomeric SMILECN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)O)O)OC
Drugpediawiki
References1. Lee,J.Chin.Chem.Soc.,39,(1992),189
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 4 of 5

ID3072
NameReticuline
Pubchem ID10233
KEGG IDC12328
SourceNeolitsea konishii
TypeNatural
FunctionDopamine Antagonist
Drug Like PropertiesYes
Molecular Weight329.39
Exact mass329.162708
Molecular formulaC19H23NO4
XlogP3
Topological Polar Surface Area62.2
H-Bond Donor2
H-Bond Acceptor5
Rotational Bond Count4
IUPAC Name1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)O)O)OC
Isomeric SMILEN/A
Drugpediawiki
References1. Lee,J.Chin.Chem.Soc.,39,(1992),189
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 5 of 5

ID3407
NameThaliporphine
Pubchem ID100020
KEGG IDN/A
SourceNeolitsea konishii
TypeNatural
FunctionAnti-hyperglycemic
Drug Like PropertiesYes
Molecular Weight341.40
Exact mass341.162708
Molecular formulaC20H23NO4
XlogP2.6
Topological Polar Surface Area51.2
H-Bond Donor1
H-Bond Acceptor5
Rotational Bond Count3
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C43)OC)OC)O)OC
Isomeric SMILEN/A
Drugpediawiki
References1. Source  
2. Function  
3. All Records