Glycoside
GD009009
Name:
1-(2-amino-1-benzofuran-3-yl)-2-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethan-1-oneFormula:
C22H23O8NSmiles:
Nc1oc2ccccc2c1C(=O)Cc1ccccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
Nc1oc2ccccc2c1C(=O)Cc1ccccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.32 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 6 |
| MolWt: | 429.43 | Num_heavy_atoms: | 31 |
| TPSA: | 155.61 | NumAromaticRings: | 3 |
Unique Aglycone
AD07119
Formula: C16H13O3N
Smiles:
Nc1oc2ccccc2c1C(=O)Cc1ccccc1O| HBA: | 4 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.06 |
| AlogP: | 3.15 | Num_rotatable_bonds: | 3 |
| MolWt: | 267.28 | Num_heavy_atoms: | 20 |
| TPSA: | 76.46 | NumAromaticRings: | 3 |
