GD029768

Name:

None

Formula:

C32H44O11N6

Smiles:

CCCCc1ccc(NC(=O)C2=CCN(C)C(C(O[C@@H]3O[C@H](CN)[C@H](O)[C@H]3O)[C@@H]3OC(n4ccc(=O)[nH]c4=O)[C@H](O)[C@H]3O)C(=O)N2C)cc1

Aglycone:

CCCCc1ccc(NC(=O)C2=CCN(C)C(CO)C(=O)N2C)cc1.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:

NCC1OC(OOC2OC(O)C(O)C2O)C(O)C1O

Other Identifiers

• CHEMBL4643063

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

AD18259

Formula: C19H27O3N3

Smiles:

CCCCc1ccc(NC(=O)C2=CCN(C)C(CO)C(=O)N2C)cc1

HBA:	6	RingCount:	2
HBD:	2	FractionCSP3:	0.47
AlogP:	1.62	Num_rotatable_bonds:	6
MolWt:	345.44	Num_heavy_atoms:	25
TPSA:	72.88	NumAromaticRings:	1