Glycoside
GD044356
Name:
NoneFormula:
C13H20O5N3Smiles:
[NH3+]C[C@@H]1O[C@H](C(=O)NCc2ccncc2)[C@H](O)[C@H](O)[C@H]1OAglycone:
O=CNCc1ccncc1Sugarmoiety:
[NH3+]CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.54 |
| AlogP: | -3.21 | Num_rotatable_bonds: | 4 |
| MolWt: | 298.32 | Num_heavy_atoms: | 21 |
| TPSA: | 139.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD24994
Formula: C7H8ON2
Smiles:
O=CNCc1ccncc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 0.33 | Num_rotatable_bonds: | 3 |
| MolWt: | 136.15 | Num_heavy_atoms: | 10 |
| TPSA: | 41.99 | NumAromaticRings: | 1 |
