GD016228

Name:

None

Formula:

C61H112O22N2

Smiles:

CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)CO[C@@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](OC(=O)C3CC(O)C(NC(C)=O)C(C(O)C(O)CO)O3)[C@H]2O)[C@H](O[C@@H]2O[C@H](C)[C@H](O)[C@H](O)[C@H]2O)[C@H]1NC(C)=O

Aglycone:

CC(=O)NC1C(O)CC(C(=O)O)OC1C(O)C(O)CO.CCCCCCCCCCCCCCC(CO)CCCCCCCCCCCCCC

Sugarmoiety:

CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1O

Other Identifiers

• CHEMBL2303852

AD11713

Formula: C11H19O8N

Smiles:

CC(=O)NC1C(O)CC(C(=O)O)OC1C(O)C(O)CO

HBA:	9	RingCount:	1
HBD:	6	FractionCSP3:	0.82
AlogP:	-3.19	Num_rotatable_bonds:	5
MolWt:	293.27	Num_heavy_atoms:	20
TPSA:	156.55	NumAromaticRings:	0

AD11714

Formula: C30H62O

Smiles:

CCCCCCCCCCCCCCC(CO)CCCCCCCCCCCCCC

HBA:	1	RingCount:	0
HBD:	1	FractionCSP3:	1.0
AlogP:	10.78	Num_rotatable_bonds:	27
MolWt:	438.83	Num_heavy_atoms:	31
TPSA:	20.23	NumAromaticRings:	0