Glycoside
GD122474
Name:
2-{[4-(3,4-dimethoxyphenyl)but-3-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C18H26O8Smiles:
COc1ccc(C=CCCOC2OC(CO)C(O)C(O)C2O)cc1OCAglycone:
COc1ccc(C=CCCO)cc1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 8 |
| MolWt: | 370.4 | Num_heavy_atoms: | 26 |
| TPSA: | 117.84 | NumAromaticRings: | 1 |
Unique Aglycone
AD49356
Formula: C12H16O3
Smiles:
COc1ccc(C=CCCO)cc1OC| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 2.1 | Num_rotatable_bonds: | 5 |
| MolWt: | 208.26 | Num_heavy_atoms: | 15 |
| TPSA: | 38.69 | NumAromaticRings: | 1 |
