Glycoside
GD002142
Name:
Rumejaposide EFormula:
C21H22O10Smiles:
Cc1cc(O)c2c(c1)[C@](O)([C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)c1cc(O)cc(O)c1C2=OAglycone:
Cc1cc(O)c2c(c1)C(O)c1cc(O)cc(O)c1C2=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.38 |
| AlogP: | -1.27 | Num_rotatable_bonds: | 2 |
| MolWt: | 434.4 | Num_heavy_atoms: | 31 |
| TPSA: | 188.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD02076
Formula: C15H12O5
Smiles:
Cc1cc(O)c2c(c1)C(O)c1cc(O)cc(O)c1C2=O| HBA: | 5 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.13 |
| AlogP: | 1.74 | Num_rotatable_bonds: | 0 |
| MolWt: | 272.26 | Num_heavy_atoms: | 20 |
| TPSA: | 97.99 | NumAromaticRings: | 2 |
