Glycoside
GD073140
Name:
NoneFormula:
C17H21O7N3Smiles:
Cc1c(NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)c(=O)n(-c2ccccc2)n1CAglycone:
Cc1c(N)c(=O)n(-c2ccccc2)n1CSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | -1.93 | Num_rotatable_bonds: | 7 |
| MolWt: | 379.37 | Num_heavy_atoms: | 27 |
| TPSA: | 154.02 | NumAromaticRings: | 2 |
Unique Aglycone
AD33969
Formula: C11H13ON3
Smiles:
Cc1c(N)c(=O)n(-c2ccccc2)n1C| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.18 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 1 |
| MolWt: | 203.25 | Num_heavy_atoms: | 15 |
| TPSA: | 52.95 | NumAromaticRings: | 2 |
