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Molecule : HD3

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C11H14N4O5/c12-11-13-8-4(9(19)14-11)1-2-15(8)10-7(18)6(17)5(3-16)20-10/h1-2,5-7,10,16-18H,3H2,(H3,12,13,14,19)/t5-,6-,7-,10-/m1/s1
2	InChIKey	InChI	1.03	JRYMOPZHXMVHTA-DAGMQNCNSA-N
3	SMILES	CACTVS	3.385	NC1=Nc2n(ccc2C(=O)N1)[CH]3O[CH](CO)[CH](O)[CH]3O
4	SMILES	OpenEye OEToolkits	2.0.7	c1cn(c2c1C(=O)NC(=N2)N)C3C(C(C(O3)CO)O)O
5	Canonical SMILES	CACTVS	3.385	NC1=Nc2n(ccc2C(=O)N1)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O
6	Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cn(c2c1C(=O)NC(=N2)N)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O