Glycoside
GD154425
Name:
2-[3-hydroxy-5-(6-hydroxyhexyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C18H28O8Smiles:
OCCCCCCc1cc(O)cc(OC2OC(CO)C(O)C(O)C2O)c1Aglycone:
OCCCCCCc1cc(O)cc(O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.67 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 9 |
| MolWt: | 372.41 | Num_heavy_atoms: | 26 |
| TPSA: | 139.84 | NumAromaticRings: | 1 |
Unique Aglycone
AD61337
Formula: C12H18O3
Smiles:
OCCCCCCc1cc(O)cc(O)c1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 2.19 | Num_rotatable_bonds: | 6 |
| MolWt: | 210.27 | Num_heavy_atoms: | 15 |
| TPSA: | 60.69 | NumAromaticRings: | 1 |
