Glycoside
GD012217
Name:
NoneFormula:
C20H29O12NSmiles:
NC(=O)[C@H](O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)c1ccccc1Aglycone:
NC(=O)C(O)c1ccccc1Sugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.65 |
| AlogP: | -4.15 | Num_rotatable_bonds: | 8 |
| MolWt: | 475.45 | Num_heavy_atoms: | 33 |
| TPSA: | 221.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD09225
Formula: C8H9O2N
Smiles:
NC(=O)C(O)c1ccccc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 151.16 | Num_heavy_atoms: | 11 |
| TPSA: | 63.32 | NumAromaticRings: | 1 |
