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Molecule : PGE

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C6H14O4/c7-1-3-9-5-6-10-4-2-8/h7-8H,1-6H2
2	InChIKey	InChI	1.03	ZIBGPFATKBEMQZ-UHFFFAOYSA-N
3	SMILES	ACDLabs	10.04	OCCOCCOCCO
4	SMILES	CACTVS	3.341	OCCOCCOCCO
5	SMILES	OpenEye OEToolkits	1.5.0	C(COCCOCCO)O
6	Canonical SMILES	CACTVS	3.341	OCCOCCOCCO
7	Canonical SMILES	OpenEye OEToolkits	1.5.0	C(COCCOCCO)O