Glycoside
GD047933
Name:
NoneFormula:
C13H16O7N2Smiles:
O=c1occ2[nH]cc(N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)cc1-2Aglycone:
Nc1c[nH]c2coc(=O)c-2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | -1.72 | Num_rotatable_bonds: | 3 |
| MolWt: | 312.28 | Num_heavy_atoms: | 22 |
| TPSA: | 148.18 | NumAromaticRings: | 0 |
Unique Aglycone
AD25740
Formula: C7H6O2N2
Smiles:
Nc1c[nH]c2coc(=O)c-2c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.65 | Num_rotatable_bonds: | 0 |
| MolWt: | 150.14 | Num_heavy_atoms: | 11 |
| TPSA: | 72.02 | NumAromaticRings: | 0 |
