GD027710

Name:

None

Formula:

C58H104O26N6S2

Smiles:

CC(=O)N[C@H]1[C@H](O)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@H]1OCCCCCNC(=O)CCCCCNC(=O)CCCSSCCCC(=O)NCCCCCC(=O)NCCCCCO[C@@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1NC(C)=O

Aglycone:

O=C(CCCCCNC(=O)CCCSSCCCC(=O)NCCCCCC(=O)NCCCCCO)NCCCCCO

Sugarmoiety:

CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1O.CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1O

Other Identifiers

• CHEMBL3752387

AD18180

Formula: C30H58O6N4S2

Smiles:

O=C(CCCCCNC(=O)CCCSSCCCC(=O)NCCCCCC(=O)NCCCCCO)NCCCCCO

HBA:	10	RingCount:	0
HBD:	6	FractionCSP3:	0.87
AlogP:	3.84	Num_rotatable_bonds:	31
MolWt:	634.95	Num_heavy_atoms:	42
TPSA:	156.86	NumAromaticRings:	0