Glycoside
GD045242
Name:
NoneFormula:
C13H19O4NSmiles:
O[C@H]1[C@H](O)CO[C@H](NCCc2ccccc2)[C@@H]1OAglycone:
NCCc1ccccc1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 4 |
| MolWt: | 253.3 | Num_heavy_atoms: | 18 |
| TPSA: | 81.95 | NumAromaticRings: | 1 |
Unique Aglycone
AD08158
Formula: C8H11N
Smiles:
NCCc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 2 |
| MolWt: | 121.18 | Num_heavy_atoms: | 9 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
