GD036041

Name:

None

Formula:

C46H70O21

Smiles:

CO[C@H]1[C@H](OC(C)=O)[C@@H](O[C@@H]2CC[C@@]3(C)[C@@H](CC[C@H]4[C@H]3CC[C@]3(C)[C@H](C5=CC(=O)OC5)[C@H](OC(C)=O)C[C@@]43O)C2)O[C@@H](C)[C@H]1O[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]1O

Aglycone:

CC(=O)OC1CC2(O)C3CCC4CC(O)CCC4(C)C3CCC2(C)C1C1=CC(=O)OC1

Sugarmoiety:

COC1C(OC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)C(C)OC(O)C1OC(C)=O

Other Identifiers

• CHEMBL4170507

AD01727

Formula: C25H36O6

Smiles:

CC(=O)OC1CC2(O)C3CCC4CC(O)CCC4(C)C3CCC2(C)C1C1=CC(=O)OC1

HBA:	6	RingCount:	5
HBD:	2	FractionCSP3:	0.84
AlogP:	3.15	Num_rotatable_bonds:	2
MolWt:	432.56	Num_heavy_atoms:	31
TPSA:	93.06	NumAromaticRings:	0