Glycoside
GD075700
Name:
NoneFormula:
C18H27O7N2Smiles:
COc1cccc(C2([NH3+])CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)CC2)c1Aglycone:
COc1cccc(C2([NH3+])CCNCC2)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.56 |
| AlogP: | -2.6 | Num_rotatable_bonds: | 7 |
| MolWt: | 383.42 | Num_heavy_atoms: | 27 |
| TPSA: | 155.17 | NumAromaticRings: | 1 |
Unique Aglycone
AD35061
Formula: C12H19ON2
Smiles:
COc1cccc(C2([NH3+])CCNCC2)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 2 |
| MolWt: | 207.3 | Num_heavy_atoms: | 15 |
| TPSA: | 48.9 | NumAromaticRings: | 1 |
