Glycoside
GD144524
Name:
1-(3-((2R,3S,4R,5R,6S)-Tetrahydro-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2H-Pyran-2-Yloxy)Furan-2-Yl)EthanoneFormula:
C12H16O8Smiles:
CC(=O)c1occc1OC1OC(CO)C(O)C(O)C1OAglycone:
CC(=O)c1occc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | -1.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 288.25 | Num_heavy_atoms: | 20 |
| TPSA: | 129.59 | NumAromaticRings: | 1 |
Unique Aglycone
AD22207
Formula: C6H6O3
Smiles:
CC(=O)c1occc1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 1 |
| MolWt: | 126.11 | Num_heavy_atoms: | 9 |
| TPSA: | 50.44 | NumAromaticRings: | 1 |
