Glycoside
...
GD033421

Name:
None

Formula:
C56H48O16N6

Smiles:
O=[N+]([O-])c1ccc(-c2c3nc(c(-c4ccc([N+](=O)[O-])cc4)c4ccc([nH]4)c(-c4ccc(OC5OC(O)C(O)C(O)C5CO)cc4)c4nc(c(-c5ccc(OC6OC(O)C(O)C(O)C6CO)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

Aglycone:
O=[N+]([O-])c1ccc(-c2c3nc(c(-c4ccc([N+](=O)[O-])cc4)c4ccc([nH]4)c(-c4ccc(O)cc4)c4nc(c(-c5ccc(O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

Sugarmoiety:
OCC1C(O)OC(O)C(O)C1O.OCC1C(O)OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 22 RingCount: 11
HBD: 10 FractionCSP3: 0.21
AlogP: 5.91 Num_rotatable_bonds: 12
MolWt: 1061.03 Num_heavy_atoms: 78
TPSA: 342.4 NumAromaticRings: 7

Unique Aglycone
AD21328
Formula: C44H28O6N6

Smiles:
O=[N+]([O-])c1ccc(-c2c3nc(c(-c4ccc([N+](=O)[O-])cc4)c4ccc([nH]4)c(-c4ccc(O)cc4)c4nc(c(-c5ccc(O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1
HBA: 12 RingCount: 9
HBD: 4 FractionCSP3: 0.0
AlogP: 10.55 Num_rotatable_bonds: 6
MolWt: 736.74 Num_heavy_atoms: 56
TPSA: 184.1 NumAromaticRings: 7

Sugarmoiety
SD03112

OCC1C(O)OC(O)C(O)C1O.OCC1C(O)OC(O)C(O)C1O