Glycoside
GD129846
Name:
Breyniaionoside AFormula:
C19H32O9Smiles:
CC1CC(=O)CC(C)(C)C1(O)C=CC(CO)OC1OC(CO)C(O)C(O)C1OAglycone:
CC1CC(=O)CC(C)(C)C1(O)C=CC(O)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.84 |
| AlogP: | -1.52 | Num_rotatable_bonds: | 6 |
| MolWt: | 404.46 | Num_heavy_atoms: | 28 |
| TPSA: | 156.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD52604
Formula: C13H22O4
Smiles:
CC1CC(=O)CC(C)(C)C1(O)C=CC(O)CO| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.77 |
| AlogP: | 0.65 | Num_rotatable_bonds: | 3 |
| MolWt: | 242.31 | Num_heavy_atoms: | 17 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
