GD012111

Name:

3Beta-O-Alpha-L-Rhamnopyranosyl-(1-3)-[Beta-D-Xylopyranosyl-(1-2)]-Beta-D+

Formula:

C58H96O25

Smiles:

C[C@@H]1O[C@H](O[C@@H]2[C@H](O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)[C@H](O[C@@H]3CO[C@H](O[C@@H]4CC[C@]5(C)[C@H](CC[C@]6(C)[C@H]5CC[C@]57OC[C@]8(CCC(C)(C)C[C@@H]58)[C@H](O)C[C@]76C)C4(C)C)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3O)O[C@H](CO)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

CC1(C)CCC23COC4(CCC5C6(C)CCC(O)C(C)(C)C6CCC5(C)C4(C)CC2O)C3C1

Sugarmoiety:

CC1OC(OC2C(O)C(CO)OC(OC3COC(O)C(OC4OC(CO)C(O)C(O)C4O)C3O)C2OC2OCC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL2442979
• CNP0166147

AD04545

Formula: C30H50O3

Smiles:

CC1(C)CCC23COC4(CCC5C6(C)CCC(O)C(C)(C)C6CCC5(C)C4(C)CC2O)C3C1

HBA:	3	RingCount:	6
HBD:	2	FractionCSP3:	1.0
AlogP:	6.35	Num_rotatable_bonds:	0
MolWt:	458.73	Num_heavy_atoms:	33
TPSA:	49.69	NumAromaticRings:	0