Glycoside
GD058402
Name:
NoneFormula:
C16H26O6NSmiles:
COc1cccc(C[C@H](C)[NH2+][C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)c1Aglycone:
COc1cccc(CC(C)[NH3+])c1Sugarmoiety:
O=CC([OH2+])C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -2.17 | Num_rotatable_bonds: | 10 |
| MolWt: | 328.39 | Num_heavy_atoms: | 23 |
| TPSA: | 123.83 | NumAromaticRings: | 1 |
Unique Aglycone
AD29201
Formula: C10H16ON
Smiles:
COc1cccc(CC(C)[NH3+])c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.4 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 3 |
| MolWt: | 166.24 | Num_heavy_atoms: | 12 |
| TPSA: | 36.87 | NumAromaticRings: | 1 |
