Glycoside
GD150301
Name:
Terezine LFormula:
C21H26O9N2Smiles:
COc1nc(C(C)C)c(OC2OC(CO)C(O)C(O)C2O)nc1C(=O)c1ccc(O)cc1Aglycone:
COc1nc(C(C)C)c(O)nc1C(=O)c1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 7 |
| MolWt: | 450.44 | Num_heavy_atoms: | 32 |
| TPSA: | 171.69 | NumAromaticRings: | 2 |
Unique Aglycone
AD60050
Formula: C15H16O4N2
Smiles:
COc1nc(C(C)C)c(O)nc1C(=O)c1ccc(O)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 2.25 | Num_rotatable_bonds: | 4 |
| MolWt: | 288.3 | Num_heavy_atoms: | 21 |
| TPSA: | 92.54 | NumAromaticRings: | 2 |
