GD131573

Name:

Capsianoside Xvii

Formula:

C44H74O21

Smiles:

C=CC(C)(CCC=C(C)CCC(O)C(=C)CCC=C(C)COC1OC(COC2OC(C)C(O)C(O)C2O)C(OC2OC(C)C(O)C(O)C2O)C(O)C1O)OC1OC(CO)C(O)C(O)C1O

Aglycone:

C=CC(C)(O)CCC=C(C)CCC(O)C(=C)CCC=C(C)CO

Sugarmoiety:

CC1OC(OCC2OC(O)C(O)C(O)C2OC2OC(C)C(O)C(O)C2O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

• CNP0289870

AD53298

Formula: C20H34O3

Smiles:

C=CC(C)(O)CCC=C(C)CCC(O)C(=C)CCC=C(C)CO

HBA:	3	RingCount:	0
HBD:	3	FractionCSP3:	0.6
AlogP:	4.07	Num_rotatable_bonds:	12
MolWt:	322.49	Num_heavy_atoms:	23
TPSA:	60.69	NumAromaticRings:	0