Glycoside
GD079548
Name:
NoneFormula:
C19H28O6N5Smiles:
C[C@@H]1CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)C[C@@H]1N(C)c1[nH+]cnc2[nH]ccc12Aglycone:
CC1CCNCC1N(C)c1[nH+]cnc2[nH]ccc12Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | -2.31 | Num_rotatable_bonds: | 7 |
| MolWt: | 422.46 | Num_heavy_atoms: | 30 |
| TPSA: | 164.36 | NumAromaticRings: | 2 |
Unique Aglycone
AD36363
Formula: C13H20N5
Smiles:
CC1CCNCC1N(C)c1[nH+]cnc2[nH]ccc12| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.54 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 2 |
| MolWt: | 246.34 | Num_heavy_atoms: | 18 |
| TPSA: | 58.09 | NumAromaticRings: | 2 |
