GD025815

Name:

None

Formula:

C32H55O13N9

Smiles:

N=C(N)NCCCCCC(=O)NCCCCCC(=O)NCCCN[C@H](C(=O)O)[C@H](O[C@@H]1O[C@H](CN)[C@H](O)[C@H]1O)[C@@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@H]1O

Aglycone:

N=C(N)NCCCCCC(=O)NCCCCCC(=O)NCCCNC(CO)C(=O)O.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:

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

Other Identifiers

• CHEMBL3288180

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

AD17082

Formula: C19H38O5N6

Smiles:

N=C(N)NCCCCCC(=O)NCCCCCC(=O)NCCCNC(CO)C(=O)O

HBA:	11	RingCount:	0
HBD:	9	FractionCSP3:	0.79
AlogP:	-0.75	Num_rotatable_bonds:	19
MolWt:	430.55	Num_heavy_atoms:	30
TPSA:	189.66	NumAromaticRings:	0