Glycoside
GD051924
Name:
NoneFormula:
C17H26O5NSmiles:
Cc1cccc2c1CC[C@@H]([NH2+][C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)C2Aglycone:
Cc1cccc2c1CCC([NH3+])C2Sugarmoiety:
OCC1OC(O)C([OH2+])C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.65 |
| AlogP: | -1.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 324.4 | Num_heavy_atoms: | 23 |
| TPSA: | 106.76 | NumAromaticRings: | 1 |
Unique Aglycone
AD27051
Formula: C11H16N
Smiles:
Cc1cccc2c1CCC([NH3+])C2| HBA: | 1 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | 1.09 | Num_rotatable_bonds: | 0 |
| MolWt: | 162.26 | Num_heavy_atoms: | 12 |
| TPSA: | 27.64 | NumAromaticRings: | 1 |
