Glycoside
GD010434
Name:
NoneFormula:
C12H13O8NSmiles:
O=C(OC1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)c1ccncc1Aglycone:
O=C(O)c1ccncc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | -1.87 | Num_rotatable_bonds: | 3 |
| MolWt: | 299.24 | Num_heavy_atoms: | 21 |
| TPSA: | 146.41 | NumAromaticRings: | 1 |
Unique Aglycone
AD08054
Formula: C6H5O2N
Smiles:
O=C(O)c1ccncc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 1 |
| MolWt: | 123.11 | Num_heavy_atoms: | 9 |
| TPSA: | 50.19 | NumAromaticRings: | 1 |
