Glycoside
GD114218
Name:
Prusianoside AFormula:
C36H56O11Smiles:
CC(C)(O)C1CCC(C)(C2C(OC3OC(CO)C(O)C(O)C3O)CC3(C)C4C=CC56OC4(CCC23C)CC5=CC(O)C(O)C6(C)C)O1Aglycone:
CC(C)(O)C1CCC(C)(C2C(O)CC3(C)C4C=CC56OC4(CCC23C)CC5=CC(O)C(O)C6(C)C)O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 7 |
| HBD: | 7 | FractionCSP3: | 0.89 |
| AlogP: | 1.48 | Num_rotatable_bonds: | 5 |
| MolWt: | 664.83 | Num_heavy_atoms: | 47 |
| TPSA: | 178.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD44909
Formula: C30H46O6
Smiles:
CC(C)(O)C1CCC(C)(C2C(O)CC3(C)C4C=CC56OC4(CCC23C)CC5=CC(O)C(O)C6(C)C)O1| HBA: | 6 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.87 |
| AlogP: | 3.65 | Num_rotatable_bonds: | 2 |
| MolWt: | 502.69 | Num_heavy_atoms: | 36 |
| TPSA: | 99.38 | NumAromaticRings: | 0 |
