Glycoside
GD155725
Name:
2-{[5-butoxy-7-(hydroxymethyl)-1H,4aH,5H,7aH-cyclopenta[c]pyran-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C19H30O9Smiles:
CCCCOC1C=C(CO)C2C(OC3OC(CO)C(O)C(O)C3O)OC=CC12Aglycone:
CCCCOC1C=C(CO)C2C(O)OC=CC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.79 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 8 |
| MolWt: | 402.44 | Num_heavy_atoms: | 28 |
| TPSA: | 138.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD61736
Formula: C13H20O4
Smiles:
CCCCOC1C=C(CO)C2C(O)OC=CC12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.69 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 5 |
| MolWt: | 240.3 | Num_heavy_atoms: | 17 |
| TPSA: | 58.92 | NumAromaticRings: | 0 |
