Glycoside
GD027552
Name:
NoneFormula:
C12H17O7NSmiles:
O=C(NC[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)c1ccco1Aglycone:
CNC(=O)c1ccco1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -2.15 | Num_rotatable_bonds: | 4 |
| MolWt: | 287.27 | Num_heavy_atoms: | 20 |
| TPSA: | 132.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD18098
Formula: C6H7O2N
Smiles:
CNC(=O)c1ccco1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 0.64 | Num_rotatable_bonds: | 1 |
| MolWt: | 125.13 | Num_heavy_atoms: | 9 |
| TPSA: | 42.24 | NumAromaticRings: | 1 |
