Glycoside
GD122302
Name:
4-(4-hydroxyphenyl)-5-(2,3,4-trihydroxybutanoyl)oxolan-2-oneFormula:
C14H16O7Smiles:
O=C1CC(c2ccc(O)cc2)C(C(=O)C(O)C(O)CO)O1Aglycone:
O=C1CC(c2ccc(O)cc2)CO1Sugarmoiety:
O=C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 5 |
| MolWt: | 296.28 | Num_heavy_atoms: | 21 |
| TPSA: | 124.29 | NumAromaticRings: | 1 |
Unique Aglycone
AD49270
Formula: C10H10O3
Smiles:
O=C1CC(c2ccc(O)cc2)CO1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.3 |
| AlogP: | 1.42 | Num_rotatable_bonds: | 1 |
| MolWt: | 178.19 | Num_heavy_atoms: | 13 |
| TPSA: | 46.53 | NumAromaticRings: | 1 |
