Glycoside
GD149453
Name:
SyringopicrosideFormula:
C24H30O11Smiles:
CC1C(=O)CC2C(C(=O)OCCc3ccc(O)cc3)=COC(OC3OC(CO)C(O)C(O)C3O)C12Aglycone:
CC1C(=O)CC2C(C(=O)OCCc3ccc(O)cc3)=COC(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -0.62 | Num_rotatable_bonds: | 7 |
| MolWt: | 494.49 | Num_heavy_atoms: | 35 |
| TPSA: | 172.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD52297
Formula: C18H20O6
Smiles:
CC1C(=O)CC2C(C(=O)OCCc3ccc(O)cc3)=COC(O)C12| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 332.35 | Num_heavy_atoms: | 24 |
| TPSA: | 93.06 | NumAromaticRings: | 1 |
