Glycoside
GD097716
Name:
NoneFormula:
C25H36O8N2Smiles:
CCN(CC)C(=O)C[C@@H]1CC2(CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)CC2)Oc2ccccc21Aglycone:
CCN(CC)C(=O)CC1CC2(CCNCC2)Oc2ccccc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 9 |
| MolWt: | 492.57 | Num_heavy_atoms: | 35 |
| TPSA: | 147.84 | NumAromaticRings: | 1 |
Unique Aglycone
AD41598
Formula: C19H28O2N2
Smiles:
CCN(CC)C(=O)CC1CC2(CCNCC2)Oc2ccccc21| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.63 |
| AlogP: | 2.93 | Num_rotatable_bonds: | 4 |
| MolWt: | 316.44 | Num_heavy_atoms: | 23 |
| TPSA: | 41.57 | NumAromaticRings: | 1 |
