Glycoside
GD129879
Name:
2-({5-chloro-4,6-dihydroxy-2,3-dioxatricyclo[5.3.1.0â´,â¸]undecan-9-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H23O10ClSmiles:
OCC1OC(OC2CC3CC4C(O)C(Cl)C(O)(OO3)C24)C(O)C(O)C1OAglycone:
OC1CC2CC3C(O)C(Cl)C(O)(OO2)C13Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -2.8 | Num_rotatable_bonds: | 3 |
| MolWt: | 398.79 | Num_heavy_atoms: | 26 |
| TPSA: | 158.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD52618
Formula: C10H13O5Cl
Smiles:
OC1CC2CC3C(O)C(Cl)C(O)(OO2)C13| HBA: | 5 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.63 | Num_rotatable_bonds: | 0 |
| MolWt: | 236.65 | Num_heavy_atoms: | 15 |
| TPSA: | 79.15 | NumAromaticRings: | 0 |
