Glycoside
GD047569
Name:
NoneFormula:
C13H23O6N2Smiles:
C[N@@H+]1C[C@H]2C[C@@H](C1)N(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)C2Aglycone:
C[NH+]1CC2CNC(C2)C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.85 |
| AlogP: | -4.62 | Num_rotatable_bonds: | 5 |
| MolWt: | 303.34 | Num_heavy_atoms: | 21 |
| TPSA: | 122.74 | NumAromaticRings: | 0 |
Unique Aglycone
AD25555
Formula: C7H15N2
Smiles:
C[NH+]1CC2CNC(C2)C1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -1.51 | Num_rotatable_bonds: | 0 |
| MolWt: | 127.21 | Num_heavy_atoms: | 9 |
| TPSA: | 16.47 | NumAromaticRings: | 0 |
