Glycoside
GD130799
Name:
3,4,5-trihydroxy-6-methoxyoxan-2-yl 3,4,5-trihydroxybenzoateFormula:
C13H16O10Smiles:
COC1OC(OC(=O)c2cc(O)c(O)c(O)c2)C(O)C(O)C1OAglycone:
O=C(O)c1cc(O)c(O)c(O)c1Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | -1.63 | Num_rotatable_bonds: | 3 |
| MolWt: | 332.26 | Num_heavy_atoms: | 23 |
| TPSA: | 166.14 | 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 |
