Glycoside
GD071690
Name:
NoneFormula:
C17H25O7N4Smiles:
CCOC(=O)C[C@H](O)CNc1[nH+]cnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CCOC(=O)CC(O)CNc1[nH+]cnc2c1C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.59 |
| AlogP: | -1.81 | Num_rotatable_bonds: | 8 |
| MolWt: | 397.41 | Num_heavy_atoms: | 28 |
| TPSA: | 160.44 | NumAromaticRings: | 2 |
Unique Aglycone
AD33670
Formula: C12H16O3N4
Smiles:
CCOC(=O)CC(O)CNc1[nH+]cnc2c1C=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 6 |
| MolWt: | 264.29 | Num_heavy_atoms: | 19 |
| TPSA: | 99.69 | NumAromaticRings: | 1 |
