Glycoside
GD005887
Name:
NoneFormula:
C9H12O6N2Smiles:
O=c1cc(O)cnn1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
O=c1cc(O)cn[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -2.44 | Num_rotatable_bonds: | 2 |
| MolWt: | 244.2 | Num_heavy_atoms: | 17 |
| TPSA: | 125.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD04934
Formula: C4H4O2N2
Smiles:
O=c1cc(O)cn[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.52 | Num_rotatable_bonds: | 0 |
| MolWt: | 112.09 | Num_heavy_atoms: | 8 |
| TPSA: | 65.98 | NumAromaticRings: | 1 |
