GD034761

Name:

None

Formula:

C22H29O12N5

Smiles:

NC(=O)[C@H](O[C@@H]1OC(C(=O)N[C@@H]2CCCCNC2=O)=C[C@H](O)[C@H]1O)[C@@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@H]1O

Aglycone:

NC(=O)COC1OC(C(=O)NC2CCCCNC2=O)=CC(O)C1O.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:

OC1OC(O)C(O)C1O

Other Identifiers

• CHEMBL4746444

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

AD01638

Formula: C14H21O7N3

Smiles:

NC(=O)COC1OC(C(=O)NC2CCCCNC2=O)=CC(O)C1O

HBA:	10	RingCount:	2
HBD:	6	FractionCSP3:	0.64
AlogP:	-2.76	Num_rotatable_bonds:	5
MolWt:	343.34	Num_heavy_atoms:	24
TPSA:	160.21	NumAromaticRings:	0