GD029506

Name:

None

Formula:

C48H83O18N

Smiles:

CCCCCCCCCCCCCC=CC(O)C(CO[C@@H]1O[C@H](CO)[C@H](O[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)[C@H](O)[C@H]1O)NC(=O)CC12CC3CC(CC(C3)C1)C2

Aglycone:

CCCCCCCCCCCCCC=CC(O)C(CO)NC(=O)CC12CC3CC(CC(C3)C1)C2

Sugarmoiety:

OCC1OC(OC2C(CO)OC(OC3C(CO)OC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL2170200

AD19189

Formula: C30H53O3N

Smiles:

CCCCCCCCCCCCCC=CC(O)C(CO)NC(=O)CC12CC3CC(CC(C3)C1)C2

HBA:	4	RingCount:	4
HBD:	3	FractionCSP3:	0.9
AlogP:	6.69	Num_rotatable_bonds:	18
MolWt:	475.76	Num_heavy_atoms:	34
TPSA:	69.56	NumAromaticRings:	0