Glycoside
GD152209
Name:
Breyniaionoside DFormula:
C19H32O8Smiles:
CC(C=CC1C2(C)COC1(C)CC(O)C2)OC1OC(CO)C(O)C(O)C1OAglycone:
CC(O)C=CC1C2(C)COC1(C)CC(O)C2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.89 |
| AlogP: | -0.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 388.46 | Num_heavy_atoms: | 27 |
| TPSA: | 128.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD52210
Formula: C13H22O3
Smiles:
CC(O)C=CC1C2(C)COC1(C)CC(O)C2| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.85 |
| AlogP: | 1.49 | Num_rotatable_bonds: | 2 |
| MolWt: | 226.32 | Num_heavy_atoms: | 16 |
| TPSA: | 49.69 | NumAromaticRings: | 0 |
