Glycoside
GD055716
Name:
NoneFormula:
C14H20O7N2Smiles:
COc1ccc(CCNC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)nc1Aglycone:
COc1ccc(CCN)nc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -2.61 | Num_rotatable_bonds: | 9 |
| MolWt: | 328.32 | Num_heavy_atoms: | 23 |
| TPSA: | 149.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD28126
Formula: C8H12ON2
Smiles:
COc1ccc(CCN)nc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 0.59 | Num_rotatable_bonds: | 3 |
| MolWt: | 152.2 | Num_heavy_atoms: | 11 |
| TPSA: | 48.14 | NumAromaticRings: | 1 |
