Glycoside
GD145620
Name:
6-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-pyran-2-oneFormula:
C12H16O8Smiles:
Cc1cc(OC2OC(CO)C(O)C(O)C2O)cc(=O)o1Aglycone:
Cc1cc(O)cc(=O)o1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | -1.87 | Num_rotatable_bonds: | 3 |
| MolWt: | 288.25 | Num_heavy_atoms: | 20 |
| TPSA: | 129.59 | NumAromaticRings: | 1 |
Unique Aglycone
AD50732
Formula: C6H6O3
Smiles:
Cc1cc(O)cc(=O)o1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 0.65 | Num_rotatable_bonds: | 0 |
| MolWt: | 126.11 | Num_heavy_atoms: | 9 |
| TPSA: | 50.44 | NumAromaticRings: | 1 |
