Glycoside
GD136466
Name:
Styraxjaponoside AFormula:
C26H30O13Smiles:
COc1cc(C(O)C2C(=O)OCC2C(O)c2ccc3c(c2)OCO3)ccc1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1cc(C(O)C2C(=O)OCC2C(O)c2ccc3c(c2)OCO3)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -0.84 | Num_rotatable_bonds: | 8 |
| MolWt: | 550.51 | Num_heavy_atoms: | 39 |
| TPSA: | 193.83 | NumAromaticRings: | 2 |
Unique Aglycone
AD55161
Formula: C20H20O8
Smiles:
COc1cc(C(O)C2C(=O)OCC2C(O)c2ccc3c(c2)OCO3)ccc1O| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.35 |
| AlogP: | 1.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 388.37 | Num_heavy_atoms: | 28 |
| TPSA: | 114.68 | NumAromaticRings: | 2 |
