Glycoside
GD122499
Name:
Stachysoside AFormula:
C21H34O15Smiles:
CC1(O)CC(O)C2(O)C=COC(OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)C12Aglycone:
CC1(O)CC(O)C2(O)C=COC(O)C12Sugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 10 | FractionCSP3: | 0.9 |
| AlogP: | -5.64 | Num_rotatable_bonds: | 6 |
| MolWt: | 526.49 | Num_heavy_atoms: | 36 |
| TPSA: | 248.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD04911
Formula: C9H14O5
Smiles:
CC1(O)CC(O)C2(O)C=COC(O)C12| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.78 |
| AlogP: | -1.29 | Num_rotatable_bonds: | 0 |
| MolWt: | 202.21 | Num_heavy_atoms: | 14 |
| TPSA: | 90.15 | NumAromaticRings: | 0 |
