Glycoside
GD055965
Name:
NoneFormula:
C14H18O7N2Smiles:
O=C(Nc1cnc2c(c1)COCC2)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
Nc1cnc2c(c1)COCC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -2.26 | Num_rotatable_bonds: | 6 |
| MolWt: | 326.31 | Num_heavy_atoms: | 23 |
| TPSA: | 149.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD28187
Formula: C8H10ON2
Smiles:
Nc1cnc2c(c1)COCC2| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 0 |
| MolWt: | 150.18 | Num_heavy_atoms: | 11 |
| TPSA: | 48.14 | NumAromaticRings: | 1 |
