GD017639

Name:

None

Formula:

C46H76O17

Smiles:

CO[C@@H]1C[C@@H]2[C@H](CC[C@@H]3C[C@H](O[C@@H]4O[C@H](CO)[C@H](O[C@@H]5O[C@H](C)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O[C@@H]4O[C@H](C)[C@H](O)[C@H](O)[C@H]4O)CC[C@]32C)[C@@H]2C[C@@H]3O[C@]4(CC[C@H](C)CO4)[C@H](C)[C@H]3[C@@]21C

Aglycone:

COC1CC2C(CCC3CC(O)CCC32C)C2CC3OC4(CCC(C)CO4)C(C)C3C12C

Sugarmoiety:

CC1OC(OC2C(O)OC(CO)C(OC3OC(C)C(O)C(O)C3O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL2049184

AD07203

Formula: C28H46O4

Smiles:

COC1CC2C(CCC3CC(O)CCC32C)C2CC3OC4(CCC(C)CO4)C(C)C3C12C

HBA:	4	RingCount:	6
HBD:	1	FractionCSP3:	1.0
AlogP:	5.42	Num_rotatable_bonds:	1
MolWt:	446.67	Num_heavy_atoms:	32
TPSA:	47.92	NumAromaticRings:	0