Glycoside
GD048932
Name:
NoneFormula:
C16H21O6NSmiles:
O=C(NCc1ccc2c(c1)CCC2)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
NCc1ccc2c(c1)CCC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.56 | Num_rotatable_bonds: | 7 |
| MolWt: | 323.35 | Num_heavy_atoms: | 23 |
| TPSA: | 127.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD26007
Formula: C10H13N
Smiles:
NCc1ccc2c(c1)CCC2| HBA: | 1 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.63 | Num_rotatable_bonds: | 1 |
| MolWt: | 147.22 | Num_heavy_atoms: | 11 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
