GD002695

Name:

None

Formula:

C48H74O20

Smiles:

CC(=O)O[C@@H]1C[C@H](O[C@H]2[C@H](C)O[C@@H](O[C@H]3[C@H](C)O[C@@H](O[C@@H]4CC[C@@]5(C)[C@@H](CC[C@H]6[C@H]5CC[C@]5(O)[C@H](C7=CC(=O)OC7)CC[C@@]65O)C4)C[C@H]3O)C[C@H]2O)O[C@H](C)[C@H]1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

CC12CCC(O)CC1CCC1C2CCC2(O)C(C3=CC(=O)OC3)CCC12O

Sugarmoiety:

CC(=O)OC1CC(OC2C(O)CC(OC3C(O)CC(O)OC3C)OC2C)OC(C)C1OC1OC(CO)C(O)C(O)C1O

Other Identifiers

• CHEMBL3391721

AD02540

Formula: C22H32O5

Smiles:

CC12CCC(O)CC1CCC1C2CCC2(O)C(C3=CC(=O)OC3)CCC12O

HBA:	5	RingCount:	5
HBD:	3	FractionCSP3:	0.86
AlogP:	2.33	Num_rotatable_bonds:	1
MolWt:	376.49	Num_heavy_atoms:	27
TPSA:	86.99	NumAromaticRings:	0