BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID2876
NameOxopurpureine
Pubchem ID284998
KEGG IDN/A
SourceAnnona purpurea
TypeNatural
FunctionAntiplatelet
Drug Like PropertiesYes
Molecular Weight381.38
Exact mass381.121237
Molecular formulaC21H19NO6
XlogP3.4
Topological Polar Surface Area76.1
H-Bond Donor0
H-Bond Acceptor7
Rotational Bond Count5
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1=C(C=C2C(=C1)C3=C(C(=C(C4=C3C(=NC=C4)C2=O)OC)OC)OC)OC
Isomeric SMILEN/A
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