Glycoside
GD055297
Name:
NoneFormula:
C13H21O7N3Smiles:
COCCn1cncc1CNC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
COCCn1cncc1CNSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -3.21 | Num_rotatable_bonds: | 10 |
| MolWt: | 331.33 | Num_heavy_atoms: | 23 |
| TPSA: | 154.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD28015
Formula: C7H13ON3
Smiles:
COCCn1cncc1CN| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.57 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 155.2 | Num_heavy_atoms: | 11 |
| TPSA: | 53.07 | NumAromaticRings: | 1 |
