Glycoside
GD067672
Name:
4-propyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-oneFormula:
C18H22O8Smiles:
CCCc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12Aglycone:
CCCc1cc(=O)oc2cc(O)ccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 5 |
| MolWt: | 366.37 | Num_heavy_atoms: | 26 |
| TPSA: | 129.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD08884
Formula: C12H12O3
Smiles:
CCCc1cc(=O)oc2cc(O)ccc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 2.45 | Num_rotatable_bonds: | 2 |
| MolWt: | 204.22 | Num_heavy_atoms: | 15 |
| TPSA: | 50.44 | NumAromaticRings: | 2 |
