Glycoside
GD046011
Name:
NoneFormula:
C14H20O5N2Smiles:
OC[C@H]1O[C@H](O)[C@H](Nc2ccc(C3CC3)cn2)[C@@H](O)[C@@H]1OAglycone:
Nc1ccc(C2CC2)cn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 4 |
| MolWt: | 296.32 | Num_heavy_atoms: | 21 |
| TPSA: | 115.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD25308
Formula: C8H10N2
Smiles:
Nc1ccc(C2CC2)cn1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 1.54 | Num_rotatable_bonds: | 1 |
| MolWt: | 134.18 | Num_heavy_atoms: | 10 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
