Glycoside
GD122746
Name:
3-(3-hydroxybenzoyl)-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]benzene-1,2,4,5-tetrolFormula:
C19H20O11Smiles:
O=C(c1cccc(O)c1)c1c(O)c(O)c(C2OC(CO)C(O)C(O)C2O)c(O)c1OAglycone:
O=C(c1cccc(O)c1)c1c(O)c(O)cc(O)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.32 |
| AlogP: | -1.04 | Num_rotatable_bonds: | 4 |
| MolWt: | 424.36 | Num_heavy_atoms: | 30 |
| TPSA: | 208.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD49493
Formula: C13H10O6
Smiles:
O=C(c1cccc(O)c1)c1c(O)c(O)cc(O)c1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.0 |
| AlogP: | 1.45 | Num_rotatable_bonds: | 2 |
| MolWt: | 262.22 | Num_heavy_atoms: | 19 |
| TPSA: | 118.22 | NumAromaticRings: | 2 |
