Glycoside
GD134308
Name:
1-(4-hydroxy-3-methoxyphenyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]-2-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-1-oneFormula:
C26H34O12Smiles:
COc1cc(CC(COC2OC(CO)C(O)C(O)C2O)C(CO)C(=O)c2ccc(O)c(OC)c2)ccc1OAglycone:
COc1cc(CC(CO)C(CO)C(=O)c2ccc(O)c(OC)c2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -0.42 | Num_rotatable_bonds: | 12 |
| MolWt: | 538.55 | Num_heavy_atoms: | 38 |
| TPSA: | 195.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD54340
Formula: C20H24O7
Smiles:
COc1cc(CC(CO)C(CO)C(=O)c2ccc(O)c(OC)c2)ccc1O| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 1.76 | Num_rotatable_bonds: | 9 |
| MolWt: | 376.41 | Num_heavy_atoms: | 27 |
| TPSA: | 116.45 | NumAromaticRings: | 2 |
