GD027534

Name:

VATALBINOSIDE E

Formula:

C40H42O17

Smiles:

OC[C@@H]1O[C@H](Oc2ccc([C@@H]3Oc4c(O)ccc5c4[C@H]3c3cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc(O)c3[C@H](c3ccc(O)cc3)[C@H]5O)cc2)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

Oc1ccc(C2Oc3c(O)ccc4c3C2c2cc(O)cc(O)c2C(c2ccc(O)cc2)C4O)cc1

Sugarmoiety:

OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

• CHEMBL1224873

AD09279

Formula: C28H22O7

Smiles:

Oc1ccc(C2Oc3c(O)ccc4c3C2c2cc(O)cc(O)c2C(c2ccc(O)cc2)C4O)cc1

HBA:	7	RingCount:	6
HBD:	6	FractionCSP3:	0.14
AlogP:	4.66	Num_rotatable_bonds:	2
MolWt:	470.48	Num_heavy_atoms:	35
TPSA:	130.61	NumAromaticRings:	4