Glycoside
GD075673
Name:
NoneFormula:
C19H30O6N3Smiles:
CC[NH+]1CCN(Cc2ccc(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)cc2)CC1Aglycone:
CC[NH+]1CCN(Cc2ccc(N)cc2)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | -3.01 | Num_rotatable_bonds: | 9 |
| MolWt: | 396.46 | Num_heavy_atoms: | 28 |
| TPSA: | 134.77 | NumAromaticRings: | 1 |
Unique Aglycone
AD35054
Formula: C13H22N3
Smiles:
CC[NH+]1CCN(Cc2ccc(N)cc2)CC1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.54 |
| AlogP: | -0.01 | Num_rotatable_bonds: | 3 |
| MolWt: | 220.34 | Num_heavy_atoms: | 16 |
| TPSA: | 33.7 | NumAromaticRings: | 1 |
