Glycoside
GD134832
Name:
rosininFormula:
C29H37O16Smiles:
COc1cc2c(c(OC3OC(C[OH2+])C(O)C(O)C3O)c1)C=C(OC1OC(CO)C(O)C(O)C1O)C(c1ccc(O)c(OC)c1)O2Aglycone:
COc1cc(O)c2c(c1)OC(c1ccc(O)c(OC)c1)C(O)=C2Sugarmoiety:
OC1OC(C[OH2+])C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 10 | FractionCSP3: | 0.52 |
| AlogP: | -2.39 | Num_rotatable_bonds: | 9 |
| MolWt: | 641.6 | Num_heavy_atoms: | 45 |
| TPSA: | 249.35 | NumAromaticRings: | 2 |
Unique Aglycone
AD54540
Formula: C17H16O6
Smiles:
COc1cc(O)c2c(c1)OC(c1ccc(O)c(OC)c1)C(O)=C2| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.18 |
| AlogP: | 3.15 | Num_rotatable_bonds: | 3 |
| MolWt: | 316.31 | Num_heavy_atoms: | 23 |
| TPSA: | 88.38 | NumAromaticRings: | 2 |
