Glycoside
GD053056
Name:
3-phenyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}prop-2-enoic acidFormula:
C15H18O8Smiles:
O=C(O)/C(=C/c1ccccc1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OAglycone:
O=C(O)C(O)=Cc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -1.07 | Num_rotatable_bonds: | 5 |
| MolWt: | 326.3 | Num_heavy_atoms: | 23 |
| TPSA: | 136.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD27228
Formula: C9H8O3
Smiles:
O=C(O)C(O)=Cc1ccccc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.67 | Num_rotatable_bonds: | 2 |
| MolWt: | 164.16 | Num_heavy_atoms: | 12 |
| TPSA: | 57.53 | NumAromaticRings: | 1 |
