Glycoside
GD006313
Name:
NoneFormula:
C22H23O10N3Smiles:
COc1c2occc2c(Cn2cc(CO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nn2)c2ccc(=O)oc12Aglycone:
COc1c2occc2c(Cn2cc(CO)nn2)c2ccc(=O)oc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | -0.5 | Num_rotatable_bonds: | 7 |
| MolWt: | 489.44 | Num_heavy_atoms: | 35 |
| TPSA: | 182.67 | NumAromaticRings: | 4 |
Unique Aglycone
AD05241
Formula: C16H13O5N3
Smiles:
COc1c2occc2c(Cn2cc(CO)nn2)c2ccc(=O)oc12| HBA: | 8 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.19 |
| AlogP: | 1.68 | Num_rotatable_bonds: | 4 |
| MolWt: | 327.3 | Num_heavy_atoms: | 24 |
| TPSA: | 103.52 | NumAromaticRings: | 4 |
