Glycoside
GD001679
Name:
PUBESCENOSIDE BFormula:
C20H26O11Smiles:
C=C(CO)C(CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)C=Cc1ccc(O)c(O)c1Aglycone:
C=C(CO)C(CO)OC(=O)C=Cc1ccc(O)c(O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.45 |
| AlogP: | -1.61 | Num_rotatable_bonds: | 9 |
| MolWt: | 442.42 | Num_heavy_atoms: | 31 |
| TPSA: | 186.37 | NumAromaticRings: | 1 |
Unique Aglycone
AD01658
Formula: C14H16O6
Smiles:
C=C(CO)C(CO)OC(=O)C=Cc1ccc(O)c(O)c1| HBA: | 6 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.21 |
| AlogP: | 0.56 | Num_rotatable_bonds: | 6 |
| MolWt: | 280.28 | Num_heavy_atoms: | 20 |
| TPSA: | 107.22 | NumAromaticRings: | 1 |
