Glycoside
GD033425
Name:
NoneFormula:
C16H18O7N2Smiles:
O=C(N[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)c1cc(-c2ccccc2)no1Aglycone:
NC(=O)c1cc(-c2ccccc2)no1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -1.13 | Num_rotatable_bonds: | 4 |
| MolWt: | 350.33 | Num_heavy_atoms: | 25 |
| TPSA: | 145.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD21331
Formula: C10H8O2N2
Smiles:
NC(=O)c1cc(-c2ccccc2)no1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.44 | Num_rotatable_bonds: | 2 |
| MolWt: | 188.19 | Num_heavy_atoms: | 14 |
| TPSA: | 69.12 | NumAromaticRings: | 2 |
