Glycoside
GD134630
Name:
Vitecannaside AFormula:
C26H30O11Smiles:
COc1cc(C2c3c(ccc(O)c3OC)C=C(C=O)C2COC2OC(CO)C(O)C(O)C2O)ccc1OAglycone:
COc1cc(C2c3c(ccc(O)c3OC)C=C(C=O)C2CO)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | 0.28 | Num_rotatable_bonds: | 8 |
| MolWt: | 518.52 | Num_heavy_atoms: | 37 |
| TPSA: | 175.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD54456
Formula: C20H20O6
Smiles:
COc1cc(C2c3c(ccc(O)c3OC)C=C(C=O)C2CO)ccc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 2.45 | Num_rotatable_bonds: | 5 |
| MolWt: | 356.37 | Num_heavy_atoms: | 26 |
| TPSA: | 96.22 | NumAromaticRings: | 2 |
