Glycoside
GD049088
Name:
NoneFormula:
C13H18O7N2Smiles:
O=C(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cc(C2CC2)on1Aglycone:
NC(=O)c1cc(C2CC2)on1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -1.92 | Num_rotatable_bonds: | 4 |
| MolWt: | 314.29 | Num_heavy_atoms: | 22 |
| TPSA: | 145.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD26048
Formula: C7H8O2N2
Smiles:
NC(=O)c1cc(C2CC2)on1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 0.65 | Num_rotatable_bonds: | 2 |
| MolWt: | 152.15 | Num_heavy_atoms: | 11 |
| TPSA: | 69.12 | NumAromaticRings: | 1 |
