Glycoside
GD068045
Name:
NoneFormula:
C16H25O5N4Smiles:
CC(C)[C@H](O)CNc1[nH+]cnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CC(C)C(O)CNc1[nH+]cnc2c1C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.62 |
| AlogP: | -1.11 | Num_rotatable_bonds: | 6 |
| MolWt: | 353.4 | Num_heavy_atoms: | 25 |
| TPSA: | 134.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD32276
Formula: C11H16ON4
Smiles:
CC(C)C(O)CNc1[nH+]cnc2c1C=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 4 |
| MolWt: | 220.28 | Num_heavy_atoms: | 16 |
| TPSA: | 73.39 | NumAromaticRings: | 1 |
