GD156484

Name:

None

Formula:

C58H106O21N2

Smiles:

CCCCCCCCCCCCCCCCCC(O)=NC(COC1OC(COC2(C(=O)O)CC(O)C(N=C(O)COC3OC(C)C(O)C(O)C3O)C(C(O)C(O)CO)O2)C(O)C(O)C1O)C(O)C=CCCCCCCCCC(C)CC

Aglycone:

CCCCCCCCCCCCCCCCCC(O)=NC(CO)C(O)C=CCCCCCCCCC(C)CC.COC1(C(=O)O)CC(O)C(N=C(O)CO)C(C(O)C(O)CO)O1

Sugarmoiety:

CC1OC(O)C(O)C(O)C1O.OC1OC(O)C(O)C(O)C1O

Other Identifiers

• CNP0436402

AD46136

Formula: C12H21O10N

Smiles:

COC1(C(=O)O)CC(O)C(N=C(O)CO)C(C(O)C(O)CO)O1

HBA:	11	RingCount:	1
HBD:	7	FractionCSP3:	0.83
AlogP:	-3.4	Num_rotatable_bonds:	7
MolWt:	339.3	Num_heavy_atoms:	23
TPSA:	189.5	NumAromaticRings:	0

AD58817

Formula: C35H69O3N

Smiles:

CCCCCCCCCCCCCCCCCC(O)=NC(CO)C(O)C=CCCCCCCCCC(C)CC

HBA:	4	RingCount:	0
HBD:	3	FractionCSP3:	0.91
AlogP:	10.65	Num_rotatable_bonds:	30
MolWt:	551.94	Num_heavy_atoms:	39
TPSA:	73.05	NumAromaticRings:	0