Glycoside
GD138312
Name:
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[4-hydroxy-5-methyl-2-(propan-2-yl)phenoxy]oxane-3,4,5-triolFormula:
C21H32O11Smiles:
Cc1cc(OC2OC(COC3OCC(O)(CO)C3O)C(O)C(O)C2O)c(C(C)C)cc1OAglycone:
Cc1cc(O)c(C(C)C)cc1OSugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.71 |
| AlogP: | -1.53 | Num_rotatable_bonds: | 7 |
| MolWt: | 460.48 | Num_heavy_atoms: | 32 |
| TPSA: | 178.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD30274
Formula: C10H14O2
Smiles:
Cc1cc(O)c(C(C)C)cc1O| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 2.53 | Num_rotatable_bonds: | 1 |
| MolWt: | 166.22 | Num_heavy_atoms: | 12 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
