Glycoside
GD064903
Name:
NoneFormula:
C16H26O7N2Smiles:
NC(=O)[C@@H]1CCC2(CCN(C(=O)[C@H]3O[C@H](O)[C@H](O)[C@@H](O)[C@H]3O)CC2)C1Aglycone:
NC(=O)C1CCC2(CCN(C=O)CC2)C1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | -2.32 | Num_rotatable_bonds: | 2 |
| MolWt: | 358.39 | Num_heavy_atoms: | 25 |
| TPSA: | 153.55 | NumAromaticRings: | 0 |
Unique Aglycone
AD31227
Formula: C11H18O2N2
Smiles:
NC(=O)C1CCC2(CCN(C=O)CC2)C1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.82 |
| AlogP: | 0.51 | Num_rotatable_bonds: | 2 |
| MolWt: | 210.28 | Num_heavy_atoms: | 15 |
| TPSA: | 63.4 | NumAromaticRings: | 0 |
