GD009197

Name:

None

Formula:

C50H72O20N10

Smiles:

CC(=O)N[C@H](CCCCNC(=O)c1cc(NC(=O)CNC(=O)[C@H](C)NC(=O)C[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc(NC(=O)CNC(=O)[C@H](C)NC(=O)C[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1)C(=O)NCC(=O)NCc1ccccc1

Aglycone:

CC(=O)NC(C)C(=O)NCC(=O)Nc1cc(NC(=O)CNC(=O)C(C)NC(C)=O)cc(C(=O)NCCCCC(NC(C)=O)C(=O)NCC(=O)NCc2ccccc2)c1

Sugarmoiety:

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

Other Identifiers

• CHEMBL2367769

AD07232

Formula: C38H52O10N10

Smiles:

CC(=O)NC(C)C(=O)NCC(=O)Nc1cc(NC(=O)CNC(=O)C(C)NC(C)=O)cc(C(=O)NCCCCC(NC(C)=O)C(=O)NCC(=O)NCc2ccccc2)c1

HBA:	20	RingCount:	2
HBD:	10	FractionCSP3:	0.42
AlogP:	-1.32	Num_rotatable_bonds:	22
MolWt:	808.89	Num_heavy_atoms:	58
TPSA:	291.0	NumAromaticRings:	2