Glycoside
GD129961
Name:
Pervianoside IFormula:
C23H26O12Smiles:
COc1cc(C2CC(=O)c3c(cc(O)cc3OC3OC(CO)C(O)C(O)C3O)O2)cc(OC)c1OAglycone:
COc1cc(C2CC(=O)c3c(O)cc(O)cc3O2)cc(OC)c1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.43 |
| AlogP: | 0.0 | Num_rotatable_bonds: | 6 |
| MolWt: | 494.45 | Num_heavy_atoms: | 35 |
| TPSA: | 184.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD52654
Formula: C17H16O7
Smiles:
COc1cc(C2CC(=O)c3c(O)cc(O)cc3O2)cc(OC)c1O| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.24 |
| AlogP: | 2.53 | Num_rotatable_bonds: | 3 |
| MolWt: | 332.31 | Num_heavy_atoms: | 24 |
| TPSA: | 105.45 | NumAromaticRings: | 2 |
