GD001723

Name:

None

Formula:

C45H52O20

Smiles:

CC1=C[C@H](c2cc3ccc(=O)oc3cc2O[C@@H]2O[C@H](COC3OC[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)[C@@](C)(C=Cc2cc3ccc(=O)oc3cc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)CC1

Aglycone:

CC1=CC(c2cc3ccc(=O)oc3cc2O)C(C)(C=Cc2cc3ccc(=O)oc3cc2O)CC1

Sugarmoiety:

OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

• CHEMBL4861101
• CHEMBL4862135
• CHEMBL4879261

AD01692

Formula: C28H24O6

Smiles:

CC1=CC(c2cc3ccc(=O)oc3cc2O)C(C)(C=Cc2cc3ccc(=O)oc3cc2O)CC1

HBA:	6	RingCount:	5
HBD:	2	FractionCSP3:	0.21
AlogP:	5.85	Num_rotatable_bonds:	3
MolWt:	456.49	Num_heavy_atoms:	34
TPSA:	100.88	NumAromaticRings:	4