Record No. 1 of 4

ID1139
NameAlpha-Erythroidine
Pubchem ID441076
KEGG IDC06531
SourceErythrina coralloides
TypeNatural
FunctionNeuromuscular blocking agent
Drug Like PropertiesYes
Molecular Weight273.33
Exact mass273.136493
Molecular formulaC16H19NO3
XlogP0.4
Topological Polar Surface Area38.8
H-Bond Donor0
H-Bond Acceptor4
Rotational Bond Count1
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1CC23C(=CCN2CCC4C3=CC(=O)OC4)C=C1
Isomeric SMILECO[C@@H]1C[C@@]23C(=CCN2CC[C@H]4C3=CC(=O)OC4)C=C1
Drugpediawiki
References1. Hargreaves,Lloydia,37,(1974),569
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 2 of 4

ID1500
NameBeta-erythroidine
Pubchem ID10074
KEGG IDC06532
SourceErythrina coralloides
TypeNatural
FunctionNeuromuscular blocking agent
Drug Like PropertiesYes
Molecular Weight273.33
Exact mass273.136493
Molecular formulaC16H19NO3
XlogP-0.2
Topological Polar Surface Area38.8
H-Bond Donor0
H-Bond Acceptor4
Rotational Bond Count1
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1CC23C4=C(CCN2CC=C3C=C1)COC(=O)C4
Isomeric SMILECO[C@@H]1C[C@]23C4=C(CCN2CC=C3C=C1)COC(=O)C4
Drugpediawiki
References1. Hargreaves,Lloydia,37,(1974),569
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 3 of 4

ID1509
NameBeta-erythroidine
Pubchem ID10074
KEGG IDC06532
SourceErythrina coralloides
TypeNatural
FunctionGanglionic blocking agent
Drug Like PropertiesYes
Molecular Weight273.33
Exact mass273.136493
Molecular formulaC16H19NO3
XlogP-0.2
Topological Polar Surface Area38.8
H-Bond Donor0
H-Bond Acceptor4
Rotational Bond Count1
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1CC23C4=C(CCN2CC=C3C=C1)COC(=O)C4
Isomeric SMILECO[C@@H]1C[C@]23C4=C(CCN2CC=C3C=C1)COC(=O)C4
Drugpediawiki
References1. Hargreaves,Lloydia,37,(1974),569
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records  
Record No. 4 of 4

ID2124
NameErythratidine
Pubchem ID442220
KEGG IDC09424
SourceErythrina coralloides
TypeNatural
FunctionNeuromuscular blocking agent
Drug Like PropertiesYes
Molecular Weight331.41
Exact mass331.178358
Molecular formulaC19H25NO4
XlogP1.2
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 SMILECOC1CC23C(=CC1O)CCN2CCC4=CC(=C(C=C34)OC)OC
Isomeric SMILECO[C@@H]1C[C@@]23C(=C[C@@H]1O)CCN2CCC4=CC(=C(C=C34)OC)OC
Drugpediawiki
References1. Hargreaves,Lloydia,37,(1974),569
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
3. Source  
4. Function  
5. All Records