Glycoside
GD147725
Name:
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenoxy]oxane-3,4,5-triolFormula:
C22H32O11Smiles:
CC(C)=CCc1cc(OC2OC(COC3OCC(O)(CO)C3O)C(O)C(O)C2O)ccc1OAglycone:
CC(C)=CCc1cc(O)ccc1OSugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.64 |
| AlogP: | -1.46 | Num_rotatable_bonds: | 8 |
| MolWt: | 472.49 | Num_heavy_atoms: | 33 |
| TPSA: | 178.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD10202
Formula: C11H14O2
Smiles:
CC(C)=CCc1cc(O)ccc1O| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 2.61 | Num_rotatable_bonds: | 2 |
| MolWt: | 178.23 | Num_heavy_atoms: | 13 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
