Glycoside
GD154724
Name:
Supinaionoside BFormula:
C19H30O8Smiles:
CC(=O)CCC1C(C)=CC(=O)CC1(C)COC1OC(CO)C(O)C(O)C1OAglycone:
CC(=O)CCC1C(C)=CC(=O)CC1(C)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.79 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 7 |
| MolWt: | 386.44 | Num_heavy_atoms: | 27 |
| TPSA: | 133.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD61426
Formula: C13H20O3
Smiles:
CC(=O)CCC1C(C)=CC(=O)CC1(C)CO| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.69 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 4 |
| MolWt: | 224.3 | Num_heavy_atoms: | 16 |
| TPSA: | 54.37 | NumAromaticRings: | 0 |
