GD106672

Name:

None

Formula:

C20H21O10N5S

Smiles:

CC(=O)O[C@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)CO[C@@H]1N1C(=O)/C(=N\NC(N)=S)c2ccc([N+](=O)[O-])cc21

Aglycone:

NC(=S)NN=C1C(=O)Nc2cc([N+](=O)[O-])ccc21

Sugarmoiety:

CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

• ZINC000106883186

AD03476

Formula: C9H7O3N5S

Smiles:

NC(=S)NN=C1C(=O)Nc2cc([N+](=O)[O-])ccc21

HBA:	8	RingCount:	2
HBD:	4	FractionCSP3:	0.0
AlogP:	0.08	Num_rotatable_bonds:	2
MolWt:	265.25	Num_heavy_atoms:	18
TPSA:	122.65	NumAromaticRings:	1