GD006152

Name:

None

Formula:

C42H62O15

Smiles:

CC1(C)[C@H]2CC[C@@]3(C)C(=CC=C4[C@@H]5C[C@@](C)(C(=O)O)CC[C@@]5(C)CC[C@]43C)[C@@]2(C)CC[C@H]1O[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

CC1(C(=O)O)CCC2(C)CCC3(C)C(=CC=C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1

Sugarmoiety:

O=C(O)C1OC(OC2C(O)OC(C(=O)O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL3400558
• CHEMBL4299545

AD05116

Formula: C30H46O3

Smiles:

CC1(C(=O)O)CCC2(C)CCC3(C)C(=CC=C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1

HBA:	3	RingCount:	5
HBD:	2	FractionCSP3:	0.83
AlogP:	7.15	Num_rotatable_bonds:	1
MolWt:	454.7	Num_heavy_atoms:	33
TPSA:	57.53	NumAromaticRings:	0