Glycoside
GD095204
Name:
NoneFormula:
C21H29O8N3Smiles:
Cc1ncccc1NC(=O)[C@@H]1CCO[C@@H]2CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)C[C@@H]21Aglycone:
Cc1ncccc1NC(=O)C1CCOC2CCNCC21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 7 |
| MolWt: | 451.48 | Num_heavy_atoms: | 32 |
| TPSA: | 169.52 | NumAromaticRings: | 1 |
Unique Aglycone
AD40644
Formula: C15H21O2N3
Smiles:
Cc1ncccc1NC(=O)C1CCOC2CCNCC21| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 275.35 | Num_heavy_atoms: | 20 |
| TPSA: | 63.25 | NumAromaticRings: | 1 |
