GD018393

Name:

None

Formula:

C45H56O15N6

Smiles:

O=C1CC(NC(=O)[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:

[NH]C1CC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)NC(Cc2ccccc2)C(=O)NC(Cc2ccccc2)CNC1=O

Sugarmoiety:

O=CC(O)C(O)C(OC1OC(CO)C(O)C(O)C1O)C(O)CO

Other Identifiers

• CHEMBL225264

AD12983

Formula: C33H35O4N6

Smiles:

[NH]C1CC(=O)NC(Cc2c[nH]c3ccccc23)C(=O)NC(Cc2ccccc2)C(=O)NC(Cc2ccccc2)CNC1=O

HBA:	10	RingCount:	5
HBD:	6	FractionCSP3:	0.27
AlogP:	1.82	Num_rotatable_bonds:	6
MolWt:	579.68	Num_heavy_atoms:	43
TPSA:	155.99	NumAromaticRings:	4