Record No. 1 of 1

ID1942
NameCorpaine
Pubchem ID442197
KEGG IDC09393
SourceCorydalis paczoskii
TypeNatural
FunctionAntiprotozoal
Drug Like PropertiesYes
Molecular Weight369.37
Exact mass369.121237
Molecular formulaC20H19NO6
XlogP1.7
Topological Polar Surface Area88.5
H-Bond Donor2
H-Bond Acceptor7
Rotational Bond Count1
IUPAC Name(1S,8'S)-7,8'-dihydroxy-6-methoxy-2-methylspiro[3,4-dihydroisoquinoline-1,7'-8H-cyclopenta[g][1,3]benzodioxole]-6'-one
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=CC(=C(C=C2C13C(C4=C(C3=O)C=CC5=C4OCO5)O)O)OC
Isomeric SMILECN1CCC2=CC(=C(C=C2[C@@]13[C@H](C4=C(C3=O)C=CC5=C4OCO5)O)O)OC
Drugpediawiki
References1. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
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