Record No. 1 of 4

ID2621
NameMagnoflorine
Pubchem ID73337
KEGG IDC09581
SourceZanthoxylum nitidum
TypeNatural
FunctionHypotensive
Drug Like PropertiesYes
Molecular Weight342.41
Exact mass342.170533
Molecular formulaC20H24NO4+
XlogP2.7
Topological Polar Surface Area58.9
H-Bond Donor2
H-Bond Acceptor4
Rotational Bond Count2
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)O)O)OC)C
Isomeric SMILEC[N+]1(CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)OC)O)O)OC)C
Drugpediawiki
References1. Moriyasu,J.Nat.Prod.,60,(1997),299
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 2 of 4

ID2669
NameMagnoflorine
Pubchem ID73337
KEGG IDC09581
SourceZanthoxylum nitidum
TypeNatural
FunctionAntioxidant
Drug Like PropertiesYes
Molecular Weight342.41
Exact mass342.170533
Molecular formulaC20H24NO4+
XlogP2.7
Topological Polar Surface Area58.9
H-Bond Donor2
H-Bond Acceptor4
Rotational Bond Count2
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)O)O)OC)C
Isomeric SMILEC[N+]1(CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)OC)O)O)OC)C
Drugpediawiki
References1. Moriyasu,J.Nat.Prod.,60,(1997),299
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 3 of 4

ID2777
NameNitidine
Pubchem ID4501
KEGG IDC09595
SourceZanthoxylum nitidum
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. Moriyasu,J.Nat.Prod.,60,(1997),299
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 4 of 4

ID2781
NameNitidine
Pubchem ID4501
KEGG IDC09595
SourceZanthoxylum nitidum
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. Moriyasu,J.Nat.Prod.,60,(1997),299
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records