GD011157

Name:

None

Formula:

C26H24O10N10

Smiles:

O=c1ccn([C@H]2O[C@@H](Cn3cc(C#CC#Cc4cn(C[C@H]5O[C@@H](n6ccc(=O)[nH]c6=O)[C@H](O)[C@H]5O)nn4)nn3)[C@H](O)[C@H]2O)c(=O)[nH]1

Aglycone:

Cn1cc(C#CC#Cc2cn(C)nn2)nn1.O=c1cc[nH]c(=O)[nH]1.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:

OC1OC(O)C(O)C1O.OC1OC(O)C(O)C1O

Other Identifiers

• CHEMBL4633955

AD00106

Formula: C4H4O2N2

Smiles:

O=c1cc[nH]c(=O)[nH]1

HBA:	4	RingCount:	1
HBD:	2	FractionCSP3:	0.0
AlogP:	-0.94	Num_rotatable_bonds:	0
MolWt:	112.09	Num_heavy_atoms:	8
TPSA:	65.72	NumAromaticRings:	1

AD08551

Formula: C10H8N6

Smiles:

Cn1cc(C#CC#Cc2cn(C)nn2)nn1

HBA:	6	RingCount:	2
HBD:	0	FractionCSP3:	0.2
AlogP:	-0.65	Num_rotatable_bonds:	0
MolWt:	212.22	Num_heavy_atoms:	16
TPSA:	61.42	NumAromaticRings:	2