GD014158

Name:

None

Formula:

C41H64O13

Smiles:

C[C@@H]1O[C@H](O[C@@H]2[C@H](O[C@@H]3CC[C@]4(C)[C@H](CC[C@]5(C)[C@H]4CC(=O)[C@]46OC(=O)[C@]7(CCC(C)(C)C[C@@H]47)CC[C@]65C)[C@@]3(C)CO)OC[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

CC1(C)CCC23CCC4(C)C5(C)CCC6C(C)(CO)C(O)CCC6(C)C5CC(=O)C4(OC2=O)C3C1

Sugarmoiety:

CC1OC(OC2C(O)OCC(O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL4074396

AD07539

Formula: C30H46O5

Smiles:

CC1(C)CCC23CCC4(C)C5(C)CCC6C(C)(CO)C(O)CCC6(C)C5CC(=O)C4(OC2=O)C3C1

HBA:	5	RingCount:	6
HBD:	2	FractionCSP3:	0.93
AlogP:	5.06	Num_rotatable_bonds:	1
MolWt:	486.69	Num_heavy_atoms:	35
TPSA:	83.83	NumAromaticRings:	0