Glycoside
GD152847
Name:
Lactoside BFormula:
C25H34O11Smiles:
CC(C)c1oc(=O)cc2c1C(O)C1OC(=O)C3(C)CC(OC4OC(CO)C(O)C(O)C4O)CC2(C)C13Aglycone:
CC(C)c1oc(=O)cc2c1C(O)C1OC(=O)C3(C)CC(O)CC2(C)C13Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.76 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 4 |
| MolWt: | 510.54 | Num_heavy_atoms: | 36 |
| TPSA: | 176.12 | NumAromaticRings: | 1 |
Unique Aglycone
AD50531
Formula: C19H24O6
Smiles:
CC(C)c1oc(=O)cc2c1C(O)C1OC(=O)C3(C)CC(O)CC2(C)C13| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.68 |
| AlogP: | 1.77 | Num_rotatable_bonds: | 1 |
| MolWt: | 348.4 | Num_heavy_atoms: | 25 |
| TPSA: | 96.97 | NumAromaticRings: | 1 |
