Protein Data Bank
in Europe

Bringing Structure to Biology

pdbe.org/chem

Download Links

Related compounds

Could not find any related compound in the PDB.

3D-Views

PDB Links

Molecule : ZF1

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H
2	InChIKey	InChI	1.03	ZQSIJRDFPHDXIC-UHFFFAOYSA-N
3	SMILES	ACDLabs	12.01	O=C1c3c(OC=C1c2ccc(O)cc2)cc(O)cc3
4	SMILES	CACTVS	3.370	Oc1ccc(cc1)C2=COc3cc(O)ccc3C2=O
5	SMILES	OpenEye OEToolkits	1.7.6	c1cc(ccc1C2=COc3cc(ccc3C2=O)O)O
6	Canonical SMILES	CACTVS	3.370	Oc1ccc(cc1)C2=COc3cc(O)ccc3C2=O
7	Canonical SMILES	OpenEye OEToolkits	1.7.6	c1cc(ccc1C2=COc3cc(ccc3C2=O)O)O