Glycoside
GD092492
Name:
3-[(3-methoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methylidene]-2,3-dihydro-1H-indol-2-oneFormula:
C22H23O8NSmiles:
COc1cc(/C=C2/C(=O)Nc3ccccc32)ccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
COc1cc(C=C2C(=O)Nc3ccccc32)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 0.37 | Num_rotatable_bonds: | 5 |
| MolWt: | 429.43 | Num_heavy_atoms: | 31 |
| TPSA: | 137.71 | NumAromaticRings: | 2 |
Unique Aglycone
AD40337
Formula: C16H13O3N
Smiles:
COc1cc(C=C2C(=O)Nc3ccccc32)ccc1O| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.06 |
| AlogP: | 2.89 | Num_rotatable_bonds: | 2 |
| MolWt: | 267.28 | Num_heavy_atoms: | 20 |
| TPSA: | 58.56 | NumAromaticRings: | 2 |
