Glycoside
GD146894
Name:
2-[2-(3,5-dihydroxybenzoyl)-3,5-dihydroxyphenoxy]-5-(hydroxymethyl)oxolane-3,4-diolFormula:
C18H18O10Smiles:
O=C(c1cc(O)cc(O)c1)c1c(O)cc(O)cc1OC1OC(CO)C(O)C1OAglycone:
O=C(c1cc(O)cc(O)c1)c1c(O)cc(O)cc1OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.28 |
| AlogP: | -0.44 | Num_rotatable_bonds: | 5 |
| MolWt: | 394.33 | Num_heavy_atoms: | 28 |
| TPSA: | 177.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD46861
Formula: C13H10O6
Smiles:
O=C(c1cc(O)cc(O)c1)c1c(O)cc(O)cc1O| 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 |
