Glycoside
...
GD000587

Name:
None

Formula:
C27H27O11N

Smiles:
O=C(OC[C@@H]1O[C@H](Oc2ccc(OCc3ccc([N+](=O)[O-])cc3)cc2CO)[C@H](O)[C@H](O)[C@H]1O)c1ccccc1

Aglycone:
COC(=O)c1ccccc1.O=[N+]([O-])c1ccc(COc2ccc(O)c(CO)c2)cc1

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 4
HBD: 4 FractionCSP3: 0.3
AlogP: 1.71 Num_rotatable_bonds: 10
MolWt: 541.51 Num_heavy_atoms: 39
TPSA: 178.05 NumAromaticRings: 3

Unique Aglycone
AD00480
Formula: C8H8O2

Smiles:
COC(=O)c1ccccc1
HBA: 2 RingCount: 1
HBD: 0 FractionCSP3: 0.12
AlogP: 1.47 Num_rotatable_bonds: 1
MolWt: 136.15 Num_heavy_atoms: 10
TPSA: 26.3 NumAromaticRings: 1
AD00639
Formula: C14H13O5N

Smiles:
O=[N+]([O-])c1ccc(COc2ccc(O)c(CO)c2)cc1
HBA: 6 RingCount: 2
HBD: 2 FractionCSP3: 0.14
AlogP: 2.37 Num_rotatable_bonds: 5
MolWt: 275.26 Num_heavy_atoms: 20
TPSA: 92.83 NumAromaticRings: 2

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O