GD122453

Name:

Depressoside

Formula:

C35H42O20

Smiles:

CC1C(OC2OC(COC(=O)c3cccc(O)c3O)C(O)C(O)C2O)CC2C(C(=O)Oc3cccc(O)c3O)=COC(OC3OC(CO)C(O)C(O)C3O)C21

Aglycone:

CC1C(O)CC2C(C(=O)Oc3cccc(O)c3O)=COC(O)C21.COC(=O)c1cccc(O)c1O

Sugarmoiety:

OC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

• CNP0234323

AD16894

Formula: C8H8O4

Smiles:

COC(=O)c1cccc(O)c1O

HBA:	4	RingCount:	1
HBD:	2	FractionCSP3:	0.12
AlogP:	0.88	Num_rotatable_bonds:	1
MolWt:	168.15	Num_heavy_atoms:	12
TPSA:	66.76	NumAromaticRings:	1

AD49342

Formula: C16H18O7

Smiles:

CC1C(O)CC2C(C(=O)Oc3cccc(O)c3O)=COC(O)C21

HBA:	7	RingCount:	3
HBD:	4	FractionCSP3:	0.44
AlogP:	0.87	Num_rotatable_bonds:	2
MolWt:	322.31	Num_heavy_atoms:	23
TPSA:	116.45	NumAromaticRings:	1