Glycoside
GD084741
Name:
NoneFormula:
C20H27O7N3Smiles:
COc1ccccc1-n1nc(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)cc1CAglycone:
COc1ccccc1-n1nc(C(=O)NCCO)cc1CSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 7 |
| MolWt: | 421.45 | Num_heavy_atoms: | 30 |
| TPSA: | 135.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD37890
Formula: C14H17O3N3
Smiles:
COc1ccccc1-n1nc(C(=O)NCCO)cc1C| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 5 |
| MolWt: | 275.31 | Num_heavy_atoms: | 20 |
| TPSA: | 76.38 | NumAromaticRings: | 2 |
