Glycoside
GD004249
Name:
NoneFormula:
C15H18O5N2Smiles:
CC(=O)c1nc([C@H](O)[C@H](O)[C@H](O)CO)c(-c2ccccc2)[nH]1Aglycone:
CC(=O)c1ncc(-c2ccccc2)[nH]1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.03 | Num_rotatable_bonds: | 6 |
| MolWt: | 306.32 | Num_heavy_atoms: | 22 |
| TPSA: | 126.67 | NumAromaticRings: | 2 |
Unique Aglycone
AD03738
Formula: C11H10ON2
Smiles:
CC(=O)c1ncc(-c2ccccc2)[nH]1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.09 |
| AlogP: | 2.28 | Num_rotatable_bonds: | 2 |
| MolWt: | 186.21 | Num_heavy_atoms: | 14 |
| TPSA: | 45.75 | NumAromaticRings: | 2 |
