Glycoside
GD103537
Name:
NoneFormula:
C19H21O12NSmiles:
COC(=O)[C@@H]1O[C@H](Oc2ccccc2[N+](=O)[O-])[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=OAglycone:
O=[N+]([O-])c1ccccc1OSugarmoiety:
COC(=O)C1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.47 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 7 |
| MolWt: | 455.37 | Num_heavy_atoms: | 32 |
| TPSA: | 166.8 | NumAromaticRings: | 1 |
Unique Aglycone
AD01290
Formula: C6H5O3N
Smiles:
O=[N+]([O-])c1ccccc1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 1 |
| MolWt: | 139.11 | Num_heavy_atoms: | 10 |
| TPSA: | 63.37 | NumAromaticRings: | 1 |
