GD021418

Name:

None

Formula:

C45H78O23N4S

Smiles:

O=C(CCCCCO[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H]1O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1O)NCCCCCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12

Aglycone:

O=C(CCCCCO)NCCCCCCNC(=O)CCCCC1SCC2NC(=O)NC21

Sugarmoiety:

OCC1OC(OCC2OC(O)C(OC3OCC(O)C(O)C3O)C(OC3OC(CO)C(O)C(O)C3O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL1669742

AD14650

Formula: C22H40O4N4S

Smiles:

O=C(CCCCCO)NCCCCCCNC(=O)CCCCC1SCC2NC(=O)NC21

HBA:	8	RingCount:	2
HBD:	5	FractionCSP3:	0.86
AlogP:	2.06	Num_rotatable_bonds:	17
MolWt:	456.65	Num_heavy_atoms:	31
TPSA:	119.56	NumAromaticRings:	0