GD025083

Name:

None

Formula:

C50H80O32N4

Smiles:

COC(=O)c1cc(OCCNC(=O)COCC(=O)NCCCO[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)cc(OCCNC(=O)COCC(=O)NCCCO[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)c1

Aglycone:

COC(=O)c1cc(OCCNC(=O)COCC(=O)NCCCO)cc(OCCNC(=O)COCC(=O)NCCCO)c1

Sugarmoiety:

OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O.OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL222761

AD16674

Formula: C26H40O12N4

Smiles:

COC(=O)c1cc(OCCNC(=O)COCC(=O)NCCCO)cc(OCCNC(=O)COCC(=O)NCCCO)c1

HBA:	16	RingCount:	1
HBD:	6	FractionCSP3:	0.58
AlogP:	-2.51	Num_rotatable_bonds:	23
MolWt:	600.62	Num_heavy_atoms:	42
TPSA:	220.08	NumAromaticRings:	1