GD017412

Name:

None

Formula:

C50H70O23

Smiles:

CO[C@H](C(=O)C(C)=O)[C@@H]1Cc2cc3cc(O[C@@H]4C[C@H](O[C@@H]5C[C@H](O)[C@H](O)[C@H](C)O5)[C@H](O)[C@H](C)O4)c(C)c(O)c3c(O)c2C(=O)[C@H]1O[C@@H]1C[C@H](O[C@@H]2C[C@H](O[C@@H]3C[C@H](O)[C@H](O)[C@H](C)O3)[C@H](O)[C@H](C)O2)[C@H](O)[C@H](C)O1

Aglycone:

COC(C(=O)C(C)=O)C1Cc2cc3cc(O)c(C)c(O)c3c(O)c2C(=O)C1O

Sugarmoiety:

CC1OC(OC2CC(O)OC(C)C2O)CC(O)C1O.CC1OC(OC2CC(OC3CC(O)OC(C)C3O)OC(C)C2O)CC(O)C1O

Other Identifiers

• CHEMBL2152295

AD12425

Formula: C20H20O8

Smiles:

COC(C(=O)C(C)=O)C1Cc2cc3cc(O)c(C)c(O)c3c(O)c2C(=O)C1O

HBA:	8	RingCount:	3
HBD:	4	FractionCSP3:	0.35
AlogP:	1.15	Num_rotatable_bonds:	4
MolWt:	388.37	Num_heavy_atoms:	28
TPSA:	141.36	NumAromaticRings:	2