GD005193

Name:

None

Formula:

C45H74O19

Smiles:

C[C@H]1CC[C@@]2(OC1)O[C@H]1C[C@@H]([C@H]3CC[C@@H]4C[C@H](O[C@@H]5O[C@@H](CO)[C@H](O[C@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)[C@H](O)[C@@H]5O[C@@H]5O[C@H](C)[C@H](O)[C@H](O)[C@H]5O)CC[C@@]4(C)[C@@H]3CC(=O)O)[C@@](C)(O)[C@@H]1[C@H]2C

Aglycone:

CC1CCC2(OC1)OC1CC(C3CCC4CC(O)CCC4(C)C3CC(=O)O)C(C)(O)C1C2C

Sugarmoiety:

CC1OC(OC2C(O)OC(CO)C(OC3OC(C)C(O)C(O)C3O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL2049187

AD04438

Formula: C27H44O6

Smiles:

CC1CCC2(OC1)OC1CC(C3CCC4CC(O)CCC4(C)C3CC(=O)O)C(C)(O)C1C2C

HBA:	6	RingCount:	5
HBD:	3	FractionCSP3:	0.96
AlogP:	4.22	Num_rotatable_bonds:	3
MolWt:	464.64	Num_heavy_atoms:	33
TPSA:	96.22	NumAromaticRings:	0