Glycoside
GD020830
Name:
URACHROMONE AFormula:
C18H22O9Smiles:
CC(C)c1cc(=O)c2c(O)cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2o1Aglycone:
CC(C)c1cc(=O)c2c(O)cc(O)cc2o1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 4 |
| MolWt: | 382.37 | Num_heavy_atoms: | 27 |
| TPSA: | 149.82 | NumAromaticRings: | 2 |
Unique Aglycone
AD05184
Formula: C12H12O4
Smiles:
CC(C)c1cc(=O)c2c(O)cc(O)cc2o1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 2.33 | Num_rotatable_bonds: | 1 |
| MolWt: | 220.22 | Num_heavy_atoms: | 16 |
| TPSA: | 70.67 | NumAromaticRings: | 2 |
