GD006936

Name:

BRIDGESIDE D2

Formula:

C50H76O21

Smiles:

CC(=O)OC[C@@]1(C)C[C@@H]2C3=CC[C@@H]4[C@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](C)[C@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@H]5CC[C@@]4(C)[C@@]3(C)[C@@H]3C[C@]2(C[C@H]1O)C(=O)O3

Aglycone:

CC(=O)OCC1(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)C3CC2(CC1O)C(=O)O3

Sugarmoiety:

CC1OC(OC2C(OC3C(O)OC(C(=O)O)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL2047222

AD05685

Formula: C32H48O6

Smiles:

CC(=O)OCC1(C)CC2C3=CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)C3CC2(CC1O)C(=O)O3

HBA:	6	RingCount:	6
HBD:	2	FractionCSP3:	0.88
AlogP:	5.2	Num_rotatable_bonds:	2
MolWt:	528.73	Num_heavy_atoms:	38
TPSA:	93.06	NumAromaticRings:	0