Record No. 1 of 1

ID2852
NameOchotensine
Pubchem ID165279
KEGG IDN/A
SourceCorydalis thyrsiflora
TypeNatural
FunctionUnknown
Drug Like PropertiesYes
Molecular Weight351.40
Exact mass351.147058
Molecular formulaC21H21NO4
XlogP3.2
Topological Polar Surface Area51.2
H-Bond Donor1
H-Bond Acceptor5
Rotational Bond Count1
IUPAC Name7-methoxy-2-methyl-6'-methylidenespiro[3,4-dihydroisoquinoline-1,7'-8H-cyclopenta[g][1,3]benzodioxole]-6-ol
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=CC(=C(C=C2C13CC4=C(C3=C)C=CC5=C4OCO5)OC)O
Isomeric SMILEN/A
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