Glycoside
GD055871
Name:
NoneFormula:
C14H21O7N3Smiles:
CC(C)Oc1nccc(CNC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)n1Aglycone:
CC(C)Oc1nccc(CN)n1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -2.48 | Num_rotatable_bonds: | 9 |
| MolWt: | 343.34 | Num_heavy_atoms: | 24 |
| TPSA: | 162.1 | NumAromaticRings: | 1 |
Unique Aglycone
AD28155
Formula: C8H13ON3
Smiles:
CC(C)Oc1nccc(CN)n1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 3 |
| MolWt: | 167.21 | Num_heavy_atoms: | 12 |
| TPSA: | 61.03 | NumAromaticRings: | 1 |
