Glycoside
GD002535
Name:
1'-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-1',2'-dihydro-1H,3H-[2,3'-biindolylidene]-2',3-dioneFormula:
C22H20O7N2Smiles:
O=C1C(=C2C(=O)N([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c3ccccc32)Nc2ccccc21Aglycone:
O=C1Nc2ccccc2C1=C1Nc2ccccc2C1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.27 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 2 |
| MolWt: | 424.41 | Num_heavy_atoms: | 31 |
| TPSA: | 139.56 | NumAromaticRings: | 2 |
Unique Aglycone
AD02413
Formula: C16H10O2N2
Smiles:
O=C1Nc2ccccc2C1=C1Nc2ccccc2C1=O| HBA: | 4 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.66 | Num_rotatable_bonds: | 0 |
| MolWt: | 262.27 | Num_heavy_atoms: | 20 |
| TPSA: | 58.2 | NumAromaticRings: | 2 |
