Glycoside
GD123758
Name:
5,7-dihydroxy-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4H-chromen-4-oneFormula:
C15H16O9Smiles:
O=c1ccoc2cc(O)c(C3OC(CO)C(O)C(O)C3O)c(O)c12Aglycone:
O=c1ccoc2cc(O)cc(O)c12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | -1.28 | Num_rotatable_bonds: | 2 |
| MolWt: | 340.28 | Num_heavy_atoms: | 24 |
| TPSA: | 160.82 | NumAromaticRings: | 2 |
Unique Aglycone
AD22716
Formula: C9H6O4
Smiles:
O=c1ccoc2cc(O)cc(O)c12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 0 |
| MolWt: | 178.14 | Num_heavy_atoms: | 13 |
| TPSA: | 70.67 | NumAromaticRings: | 2 |
