Glycoside
GD091418
Name:
NoneFormula:
C20H30O8N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ncccc2OCC2CCOCC2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1ncccc1OCC1CCOCC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.7 |
| AlogP: | -0.54 | Num_rotatable_bonds: | 8 |
| MolWt: | 426.47 | Num_heavy_atoms: | 30 |
| TPSA: | 139.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD39886
Formula: C14H20O4N2
Smiles:
O=C(NCCO)c1ncccc1OCC1CCOCC1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.57 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 6 |
| MolWt: | 280.32 | Num_heavy_atoms: | 20 |
| TPSA: | 80.68 | NumAromaticRings: | 1 |
