Glycoside
GD025124
Name:
NoneFormula:
C21H23O6N3Smiles:
Cc1ccc(-c2nc3ccccc3c(=O)n2NC2OC(CO)C(O)C(O)C2O)cc1Aglycone:
Cc1ccc(-c2nc3ccccc3c(=O)n2N)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 4 |
| MolWt: | 413.43 | Num_heavy_atoms: | 30 |
| TPSA: | 137.07 | NumAromaticRings: | 3 |
Unique Aglycone
AD16696
Formula: C15H13ON3
Smiles:
Cc1ccc(-c2nc3ccccc3c(=O)n2N)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 2.09 | Num_rotatable_bonds: | 1 |
| MolWt: | 251.29 | Num_heavy_atoms: | 19 |
| TPSA: | 60.91 | NumAromaticRings: | 3 |
