Glycoside
GD141297
Name:
1-(2,4-dihydroxyphenyl)-3-(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)propan-1-oneFormula:
C21H24O9Smiles:
O=C(CCc1ccc(OC2OC(CO)C(O)C(O)C2O)cc1)c1ccc(O)cc1OAglycone:
O=C(CCc1ccc(O)cc1)c1ccc(O)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.38 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 7 |
| MolWt: | 420.41 | Num_heavy_atoms: | 30 |
| TPSA: | 156.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD05271
Formula: C15H14O4
Smiles:
O=C(CCc1ccc(O)cc1)c1ccc(O)cc1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.13 |
| AlogP: | 2.62 | Num_rotatable_bonds: | 4 |
| MolWt: | 258.27 | Num_heavy_atoms: | 19 |
| TPSA: | 77.76 | NumAromaticRings: | 2 |
