Glycoside
GD088631
Name:
NoneFormula:
C21H21O7N3Smiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1nn(-c2ccccc2)c(=O)c2ccccc12Aglycone:
NC(=O)c1nn(-c2ccccc2)c(=O)c2ccccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | -1.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 427.41 | Num_heavy_atoms: | 31 |
| TPSA: | 154.14 | NumAromaticRings: | 3 |
Unique Aglycone
AD38786
Formula: C15H11O2N3
Smiles:
NC(=O)c1nn(-c2ccccc2)c(=O)c2ccccc12| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.48 | Num_rotatable_bonds: | 2 |
| MolWt: | 265.27 | Num_heavy_atoms: | 20 |
| TPSA: | 77.98 | NumAromaticRings: | 3 |
