Glycoside
GD147560
Name:
2-[4-(2,3-dihydroxypropyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C15H22O8Smiles:
OCC(O)Cc1ccc(OC2OC(CO)C(O)C(O)C2O)cc1Aglycone:
OCC(O)Cc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.6 |
| AlogP: | -2.24 | Num_rotatable_bonds: | 6 |
| MolWt: | 330.33 | Num_heavy_atoms: | 23 |
| TPSA: | 139.84 | NumAromaticRings: | 1 |
Unique Aglycone
AD59087
Formula: C9H12O3
Smiles:
OCC(O)Cc1ccc(O)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 0.29 | Num_rotatable_bonds: | 3 |
| MolWt: | 168.19 | Num_heavy_atoms: | 12 |
| TPSA: | 60.69 | NumAromaticRings: | 1 |
