Glycoside
GD079578
Name:
NoneFormula:
C20H30O7N3Smiles:
CO[C@@H]1CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)[C@@H]2C[N@H+](Cc3cccnc3)C[C@@H]21Aglycone:
COC1CCNC2C[NH+](Cc3cccnc3)CC21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -3.64 | Num_rotatable_bonds: | 8 |
| MolWt: | 424.47 | Num_heavy_atoms: | 30 |
| TPSA: | 144.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD36370
Formula: C14H22ON3
Smiles:
COC1CCNC2C[NH+](Cc3cccnc3)CC21| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.64 |
| AlogP: | -0.53 | Num_rotatable_bonds: | 3 |
| MolWt: | 248.35 | Num_heavy_atoms: | 18 |
| TPSA: | 38.59 | NumAromaticRings: | 1 |
