Record No. 1 of 2

ID1249
NameAtherospermidine
Pubchem ID77514
KEGG IDC09347
SourceArtabotrys maingayi
TypeNatural
FunctionCytotoxic
Drug Like PropertiesYes
Molecular Weight305.28
Exact mass305.068808
Molecular formulaC18H11NO4
XlogP3.4
Topological Polar Surface Area57.7
H-Bond Donor0
H-Bond Acceptor5
Rotational Bond Count1
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1=C2C(=C3C4=CC=CC=C4C(=O)C5=NC=CC1=C35)OCO2
Isomeric SMILEN/A
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Record No. 2 of 2

ID2807
NameNorstephalagine
Pubchem ID133381
KEGG IDN/A
SourceArtabotrys maingayi
TypeNatural
FunctionSmooth muscle relaxant
Drug Like PropertiesYes
Molecular Weight295.33
Exact mass295.120843
Molecular formulaC18H17NO3
XlogP2.8
Topological Polar Surface Area39.7
H-Bond Donor1
H-Bond Acceptor4
Rotational Bond Count1
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1=C2CCNC3C2=C(C4=CC=CC=C4C3)C5=C1OCO5
Isomeric SMILECOC1=C2CCN[C@H]3C2=C(C4=CC=CC=C4C3)C5=C1OCO5
Drugpediawiki
References1. Source  
2. Function  
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