GD114238

Name:

None

Formula:

C47H76O23

Smiles:

C=CC(C)(CCC=C(C)CCC=C(C)CCC=C(C)COC1C(C)OC(OC2C(CO)OC(O)C(O)C2O)C(O)C1O)OC1C(C)OC(OC2C(CO)OC(O)C(OC(=O)CC(=O)O)C2O)C(O)C1O

Aglycone:

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

Sugarmoiety:

CC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O.CC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CNP0436944

AD03073

Formula: C20H34O2

Smiles:

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

HBA:	2	RingCount:	0
HBD:	2	FractionCSP3:	0.6
AlogP:	5.1	Num_rotatable_bonds:	11
MolWt:	306.49	Num_heavy_atoms:	22
TPSA:	40.46	NumAromaticRings:	0

AD13454

Formula: C3H4O4

Smiles:

O=C(O)CC(=O)O

HBA:	4	RingCount:	0
HBD:	2	FractionCSP3:	0.33
AlogP:	-0.45	Num_rotatable_bonds:	2
MolWt:	104.06	Num_heavy_atoms:	7
TPSA:	74.6	NumAromaticRings:	0