GD002017

Name:

None

Formula:

C45H58O14N6

Smiles:

O=C1C[C@H](NC[C@H](O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)CO)C(=O)NC[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N1

Aglycone:

CNC1CC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)NC(Cc2ccccc2)C(=O)NC(Cc2ccccc2)CNC1=O

Sugarmoiety:

OCC(O)C(OC1OC(CO)C(O)C(O)C1O)C(O)C(O)O

Other Identifiers

• CHEMBL223994
• CHEMBL436804

AD01964

Formula: C34H38O4N6

Smiles:

CNC1CC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)NC(Cc2ccccc2)C(=O)NC(Cc2ccccc2)CNC1=O

HBA:	10	RingCount:	5
HBD:	6	FractionCSP3:	0.29
AlogP:	1.76	Num_rotatable_bonds:	7
MolWt:	594.72	Num_heavy_atoms:	44
TPSA:	144.22	NumAromaticRings:	4