BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID2163
NameFluorescein colchicine
Pubchem ID3035871
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesNo
Molecular Weight746.78
Exact mass746.193416
Molecular formulaC41H34N2O10S
XlogP4.5
Topological Polar Surface Area154
H-Bond Donor4
H-Bond Acceptor10
Rotational Bond Count6
IUPAC Name3-(3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)-1-(1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[d]heptalen-7-yl)thiourea
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1=CC=C2C(=CC1=O)C(CCC3=CC(=C(C(=C32)OC)OC)OC)NC(=S)NC4=CC5=C(C=C4)C6(C7=C(C=C(C=C7)O)OC8=C6C=CC(=C8)O)OC5=O
Isomeric SMILEN/A
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