BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID3038
NamePuterine
Pubchem ID191751
KEGG IDN/A
SourceGuatteria elata
TypeNatural
FunctionUnknown
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=CC=CC2=C1C3=C4C(C2)NCCC4=CC5=C3OCO5
Isomeric SMILECOC1=CC=CC2=C1C3=C4[C@@H](C2)NCCC4=CC5=C3OCO5
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