GD030687

Name:

None

Formula:

C39H67O12N5

Smiles:

CCCCCCCCCCCCCCCCC[C@@H]1CN(C)[C@H]([C@H](O[C@@H]2O[C@H](CN)[C@H](O)[C@H]2O)[C@@H]2O[C@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@H]2O)C(=O)N(C)[C@H]1C(=O)O

Aglycone:

CCCCCCCCCCCCCCCCCC1CN(C)C(CO)C(=O)N(C)C1C(=O)O.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:

NCC1OC(OOC2OC(O)C(O)C2O)C(O)C1O

Other Identifiers

• CHEMBL4466734

AD00106

Formula: C4H4O2N2

Smiles:

O=c1cc[nH]c(=O)[nH]1

HBA:	4	RingCount:	1
HBD:	2	FractionCSP3:	0.0
AlogP:	-0.94	Num_rotatable_bonds:	0
MolWt:	112.09	Num_heavy_atoms:	8
TPSA:	65.72	NumAromaticRings:	1

AD19842

Formula: C26H50O4N2

Smiles:

CCCCCCCCCCCCCCCCCC1CN(C)C(CO)C(=O)N(C)C1C(=O)O

HBA:	6	RingCount:	1
HBD:	2	FractionCSP3:	0.92
AlogP:	5.08	Num_rotatable_bonds:	18
MolWt:	454.7	Num_heavy_atoms:	32
TPSA:	81.08	NumAromaticRings:	0