GD011434

Name:

None

Formula:

C54H80O13N4

Smiles:

CCOc1ccc(-n2cc(COC(=O)[C@@]34CCC(C)(C)C[C@H]3C3=CC[C@@H]5[C@]6(C)CC[C@H](O[C@@H]7O[C@H](CO[C@@H]8OC[C@H](O)[C@H](O)[C@H]8O)[C@H](O)[C@H](O)[C@H]7NC(C)=O)C(C)(C)[C@H]6CC[C@@]5(C)[C@@]3(C)CC4)nn2)cc1

Aglycone:

CCOc1ccc(-n2cc(COC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CCC(O)C(C)(C)C6CCC5(C)C3(C)CC4)nn2)cc1

Sugarmoiety:

CC(=O)NC1C(O)OC(COC2OCC(O)C(O)C2O)C(O)C1O

Other Identifiers

• CHEMBL4278528

AD08744

Formula: C41H59O4N3

Smiles:

CCOc1ccc(-n2cc(COC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CCC(O)C(C)(C)C6CCC5(C)C3(C)CC4)nn2)cc1

HBA:	7	RingCount:	7
HBD:	1	FractionCSP3:	0.73
AlogP:	8.87	Num_rotatable_bonds:	6
MolWt:	657.94	Num_heavy_atoms:	48
TPSA:	86.47	NumAromaticRings:	2