Glycoside
GD082230
Name:
NoneFormula:
C20H28O7N2Smiles:
CN1[C@@H](C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)C[C@]2(C)COc3ccccc3[C@H]12Aglycone:
CN1C(C(N)=O)CC2(C)COc3ccccc3C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -1.25 | Num_rotatable_bonds: | 3 |
| MolWt: | 408.45 | Num_heavy_atoms: | 29 |
| TPSA: | 131.72 | NumAromaticRings: | 1 |
Unique Aglycone
AD36925
Formula: C14H18O2N2
Smiles:
CN1C(C(N)=O)CC2(C)COc3ccccc3C12| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.32 | Num_rotatable_bonds: | 1 |
| MolWt: | 246.31 | Num_heavy_atoms: | 18 |
| TPSA: | 55.56 | NumAromaticRings: | 1 |
