Glycoside
GD071653
Name:
NoneFormula:
C20H29O6N2Smiles:
O=C(N[C@H]1C[C@@H]2CC[C@H](C1)[N@H+]2Cc1ccccc1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
NC1CC2CCC(C1)[NH+]2Cc1ccccc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.6 |
| AlogP: | -2.47 | Num_rotatable_bonds: | 8 |
| MolWt: | 393.46 | Num_heavy_atoms: | 28 |
| TPSA: | 131.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD33654
Formula: C14H21N2
Smiles:
NC1CC2CCC(C1)[NH+]2Cc1ccccc1| HBA: | 2 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.57 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 2 |
| MolWt: | 217.34 | Num_heavy_atoms: | 16 |
| TPSA: | 30.46 | NumAromaticRings: | 1 |
