GD014696

Name:

None

Formula:

C26H43O12N9S

Smiles:

CNC1C(OC2C(OC3C(O)C(O)C(NC(=N)N)C(O)C3NC(=N)N)OC(C)C2(O)C=NNC(=O)c2cccs2)OC(CO)C(O)C1O

Aglycone:

C=NNC(=O)c1cccs1.N=C(N)NC1C(O)C(O)C(O)C(NC(=N)N)C1O

Sugarmoiety:

CNC1C(OC2C(O)OC(C)C2(O)O)OC(CO)C(O)C1O

Other Identifiers

• CHEMBL3091661

AD07399

Formula: C8H18O4N6

Smiles:

N=C(N)NC1C(O)C(O)C(O)C(NC(=N)N)C1O

HBA:	10	RingCount:	1
HBD:	12	FractionCSP3:	0.75
AlogP:	-4.85	Num_rotatable_bonds:	2
MolWt:	262.27	Num_heavy_atoms:	18
TPSA:	204.72	NumAromaticRings:	0

AD08590

Formula: C6H6ON2S

Smiles:

C=NNC(=O)c1cccs1

HBA:	3	RingCount:	1
HBD:	1	FractionCSP3:	0.0
AlogP:	1.09	Num_rotatable_bonds:	2
MolWt:	154.19	Num_heavy_atoms:	10
TPSA:	41.46	NumAromaticRings:	1