Glycoside
GD126882
Name:
4-(4-hydroxyphenyl)-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}but-3-en-2-oneFormula:
C16H20O8Smiles:
O=C(C=Cc1ccc(O)cc1)COC1OC(CO)C(O)C(O)C1OAglycone:
O=C(C=Cc1ccc(O)cc1)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -1.21 | Num_rotatable_bonds: | 6 |
| MolWt: | 340.33 | Num_heavy_atoms: | 24 |
| TPSA: | 136.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD51360
Formula: C10H10O3
Smiles:
O=C(C=Cc1ccc(O)cc1)CO| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 0.97 | Num_rotatable_bonds: | 3 |
| MolWt: | 178.19 | Num_heavy_atoms: | 13 |
| TPSA: | 57.53 | NumAromaticRings: | 1 |
