GD012752

Name:

None

Formula:

C34H54O11N6

Smiles:

CN1C(=O)[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)N(C)CC=C1C(=O)NC1CCCCCCCCCCC1

Aglycone:

CN1C(=O)C(CO)N(C)CC=C1C(=O)NC1CCCCCCCCCCC1.O=c1cc[nH]c(=O)[nH]1

Sugarmoiety:

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

Other Identifiers

• CHEMBL4551168

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

AD09583

Formula: C21H37O3N3

Smiles:

CN1C(=O)C(CO)N(C)CC=C1C(=O)NC1CCCCCCCCCCC1

HBA:	6	RingCount:	2
HBD:	2	FractionCSP3:	0.81
AlogP:	2.42	Num_rotatable_bonds:	3
MolWt:	379.55	Num_heavy_atoms:	27
TPSA:	72.88	NumAromaticRings:	0