GD027849

Name:

None

Formula:

C37H47O14N5

Smiles:

O=C1CCN([C@@H]2O[C@H](CNC(=O)[C@H](CCCNC(=O)OCC3c4ccccc4-c4ccccc43)NC(=O)C[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)C(=O)N1

Aglycone:

CNC(=O)C(CCCNC(=O)OCC1c2ccccc2-c2ccccc21)NC(C)=O.O=C1CCNC(=O)N1

Sugarmoiety:

OC1OC(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

• CHEMBL1644892

AD01822

Formula: C4H6O2N2

Smiles:

O=C1CCNC(=O)N1

HBA:	4	RingCount:	1
HBD:	2	FractionCSP3:	0.5
AlogP:	-0.78	Num_rotatable_bonds:	0
MolWt:	114.1	Num_heavy_atoms:	8
TPSA:	58.2	NumAromaticRings:	0

AD12368

Formula: C23H27O4N3

Smiles:

CNC(=O)C(CCCNC(=O)OCC1c2ccccc2-c2ccccc21)NC(C)=O

HBA:	7	RingCount:	3
HBD:	3	FractionCSP3:	0.35
AlogP:	2.56	Num_rotatable_bonds:	8
MolWt:	409.49	Num_heavy_atoms:	30
TPSA:	96.53	NumAromaticRings:	2