Glycoside
GD147063
Name:
1-(2,4-dihydroxyphenyl)-3-hydroxy-3-(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)-3,4,5,6-tetramethyloxan-2-yl]oxy}phenyl)propan-1-oneFormula:
C25H32O10Smiles:
CC1(CO)OC(Oc2ccc(C(O)CC(=O)c3ccc(O)cc3O)cc2)C(C)(O)C(C)(O)C1(C)OAglycone:
O=C(CC(O)c1ccc(O)cc1)c1ccc(O)cc1OSugarmoiety:
CC1(CO)OC(O)C(C)(O)C(C)(O)C1(C)OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.48 |
| AlogP: | 1.14 | Num_rotatable_bonds: | 7 |
| MolWt: | 492.52 | Num_heavy_atoms: | 35 |
| TPSA: | 177.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD48611
Formula: C15H14O5
Smiles:
O=C(CC(O)c1ccc(O)cc1)c1ccc(O)cc1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.13 |
| AlogP: | 2.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 274.27 | Num_heavy_atoms: | 20 |
| TPSA: | 97.99 | NumAromaticRings: | 2 |
