Glycoside
GD144344
Name:
Crotalionoside AFormula:
C19H32O9Smiles:
CC(O)C=C=C1C(C)(C)CC(O)C(OC2OC(CO)C(O)C(O)C2O)C1(C)OAglycone:
CC(O)C=C=C1C(C)(C)CC(O)C(O)C1(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.84 |
| AlogP: | -1.82 | Num_rotatable_bonds: | 4 |
| MolWt: | 404.46 | Num_heavy_atoms: | 28 |
| TPSA: | 160.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD58009
Formula: C13H22O4
Smiles:
CC(O)C=C=C1C(C)(C)CC(O)C(O)C1(C)O| HBA: | 4 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.77 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 1 |
| MolWt: | 242.31 | Num_heavy_atoms: | 17 |
| TPSA: | 80.92 | NumAromaticRings: | 0 |
