Glycoside
GD120821
Name:
6-(4-carboxy-2,6-dihydroxyphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acidFormula:
C13H14O11Smiles:
O=C(O)c1cc(O)c(OC2OC(C(=O)O)C(O)C(O)C2O)c(O)c1Aglycone:
O=C(O)c1cc(O)c(O)c(O)c1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.38 |
| AlogP: | -1.93 | Num_rotatable_bonds: | 4 |
| MolWt: | 346.24 | Num_heavy_atoms: | 24 |
| TPSA: | 194.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD00518
Formula: C7H6O5
Smiles:
O=C(O)c1cc(O)c(O)c(O)c1| HBA: | 5 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 0.5 | Num_rotatable_bonds: | 1 |
| MolWt: | 170.12 | Num_heavy_atoms: | 12 |
| TPSA: | 97.99 | NumAromaticRings: | 1 |
