Glycoside
GD025430
Name:
NoneFormula:
C20H21O5N3Smiles:
Cc1nc2ccc(NC3OCC(O)C(O)C3O)cc2c(=O)n1-c1ccccc1Aglycone:
Cc1nc2ccc(N)cc2c(=O)n1-c1ccccc1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.3 |
| AlogP: | 0.55 | Num_rotatable_bonds: | 3 |
| MolWt: | 383.4 | Num_heavy_atoms: | 28 |
| TPSA: | 116.84 | NumAromaticRings: | 3 |
Unique Aglycone
AD14763
Formula: C15H13ON3
Smiles:
Cc1nc2ccc(N)cc2c(=O)n1-c1ccccc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 2.28 | Num_rotatable_bonds: | 1 |
| MolWt: | 251.29 | Num_heavy_atoms: | 19 |
| TPSA: | 60.91 | NumAromaticRings: | 3 |
