GD024487

Name:

None

Formula:

C19H29O13N5

Smiles:

NC[C@@H]1O[C@H](O[C@H]([C@H](N)C(=O)N[C@H](CO)C(=O)O)[C@@H]2O[C@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O

Aglycone:

NC(CO)C(=O)NC(CO)C(=O)O.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:

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

Other Identifiers

• CHEMBL407665

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

AD16334

Formula: C6H12O5N2

Smiles:

NC(CO)C(=O)NC(CO)C(=O)O

HBA:	7	RingCount:	0
HBD:	6	FractionCSP3:	0.67
AlogP:	-3.13	Num_rotatable_bonds:	5
MolWt:	192.17	Num_heavy_atoms:	13
TPSA:	132.88	NumAromaticRings:	0