GD030211

Name:

None

Formula:

C55H86O24

Smiles:

CC(=O)O[C@@H]1[C@H](C)O[C@H](OC(=O)[C@@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@]5(C)C[C@H](O)[C@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[C@@](C)(C(=O)O)[C@H]5CC[C@@]4(C)[C@@]2(C)CC3)[C@H](O[C@@H]2O[C@H](C)[C@H](O)[C@H](O)[C@H]2O)[C@H]1O[C@@H]1OC[C@](O)(CO)[C@H]1O

Aglycone:

CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C(=O)O)C5CCC43C)C2C1

Sugarmoiety:

CC(=O)OC1C(C)OC(O)C(OC2OC(C)C(O)C(O)C2O)C1OC1OCC(O)(CO)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

• CHEMBL4214983

AD00250

Formula: C30H46O6

Smiles:

CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C(=O)O)C5CCC43C)C2C1

HBA:	6	RingCount:	5
HBD:	4	FractionCSP3:	0.87
AlogP:	5.27	Num_rotatable_bonds:	2
MolWt:	502.69	Num_heavy_atoms:	36
TPSA:	115.06	NumAromaticRings:	0