Glycoside
GD137019
Name:
2-({4-hydroxy-2,10-dioxatricyclo[5.3.1.0â´,â¸]undec-5-en-9-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C15H22O9Smiles:
OCC1OC(OC2OC3CC4C=CC(O)(CO3)C42)C(O)C(O)C1OAglycone:
OC1OC2CC3C=CC(O)(CO2)C31Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.87 |
| AlogP: | -2.56 | Num_rotatable_bonds: | 3 |
| MolWt: | 346.33 | Num_heavy_atoms: | 24 |
| TPSA: | 138.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD55374
Formula: C9H12O4
Smiles:
OC1OC2CC3C=CC(O)(CO2)C31| HBA: | 4 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.78 |
| AlogP: | -0.39 | Num_rotatable_bonds: | 0 |
| MolWt: | 184.19 | Num_heavy_atoms: | 13 |
| TPSA: | 58.92 | NumAromaticRings: | 0 |
