Glycoside
GD023712
Name:
NoneFormula:
C29H38O7N5FSmiles:
COc1ccccc1N1CCN(Cc2cn(-c3ccc(OCCCOC4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4F)cc3)nn2)CC1Aglycone:
COc1ccccc1N1CCN(Cc2cn(-c3ccc(OCCCO)cc3)nn2)CC1Sugarmoiety:
OCC1OC(O)C(F)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.52 |
| AlogP: | 1.16 | Num_rotatable_bonds: | 12 |
| MolWt: | 587.65 | Num_heavy_atoms: | 42 |
| TPSA: | 134.8 | NumAromaticRings: | 3 |
Unique Aglycone
AD15923
Formula: C23H29O3N5
Smiles:
COc1ccccc1N1CCN(Cc2cn(-c3ccc(OCCCO)cc3)nn2)CC1| HBA: | 8 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.39 |
| AlogP: | 2.36 | Num_rotatable_bonds: | 9 |
| MolWt: | 423.52 | Num_heavy_atoms: | 31 |
| TPSA: | 75.88 | NumAromaticRings: | 3 |
