GD011024

Name:

None

Formula:

C39H66O16N2

Smiles:

CC[C@@H]1OC(=O)C[C@H](O)[C@H](C)[C@H](O[C@@H]2O[C@H](C)[C@H](O)[C@H](N(C)C)[C@H]2O)[C@H](CCO[N+](=O)[O-])C[C@H](C)C(=O)C=CC(C)=C[C@H]1CO[C@@H]1O[C@H](C)[C@H](O)[C@H](OC)[C@H]1OC

Aglycone:

CCC1OC(=O)CC(O)C(C)C(O)C(CCO[N+](=O)[O-])CC(C)C(=O)C=CC(C)=CC1CO

Sugarmoiety:

CC1OC(O)C(O)C(N(C)C)C1O.COC1C(O)OC(C)C(O)C1OC

Other Identifiers

• CHEMBL416087

AD08454

Formula: C23H37O9N

Smiles:

CCC1OC(=O)CC(O)C(C)C(O)C(CCO[N+](=O)[O-])CC(C)C(=O)C=CC(C)=CC1CO

HBA:	10	RingCount:	1
HBD:	3	FractionCSP3:	0.74
AlogP:	1.99	Num_rotatable_bonds:	6
MolWt:	471.55	Num_heavy_atoms:	33
TPSA:	156.43	NumAromaticRings:	0