Glycoside
GD114766
Name:
2-{4-hydroxy-2-[1-(4-hydroxyphenyl)penta-2,4-dien-1-yl]-6-methoxyphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C24H28O9Smiles:
C=CC=CC(c1ccc(O)cc1)c1cc(O)cc(OC)c1OC1OC(CO)C(O)C(O)C1OAglycone:
C=CC=CC(c1ccc(O)cc1)c1cc(O)cc(OC)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | 1.16 | Num_rotatable_bonds: | 8 |
| MolWt: | 460.48 | Num_heavy_atoms: | 33 |
| TPSA: | 149.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD45270
Formula: C18H18O4
Smiles:
C=CC=CC(c1ccc(O)cc1)c1cc(O)cc(OC)c1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.11 |
| AlogP: | 3.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 298.34 | Num_heavy_atoms: | 22 |
| TPSA: | 69.92 | NumAromaticRings: | 2 |
