Glycoside
GD118303
Name:
5-ethenyl-4-hydroxy-8-methoxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,3H,4H,5H,6H,8H-pyrano[3,4-c]pyran-1-oneFormula:
C17H24O11Smiles:
C=CC1C2=C(C(=O)OCC2O)C(OC)OC1OC1OC(CO)C(O)C(O)C1OAglycone:
C=CC1C2=C(C(=O)OCC2O)C(OC)OC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | -2.85 | Num_rotatable_bonds: | 5 |
| MolWt: | 404.37 | Num_heavy_atoms: | 28 |
| TPSA: | 164.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD47288
Formula: C11H14O6
Smiles:
C=CC1C2=C(C(=O)OCC2O)C(OC)OC1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.55 |
| AlogP: | -0.68 | Num_rotatable_bonds: | 2 |
| MolWt: | 242.23 | Num_heavy_atoms: | 17 |
| TPSA: | 85.22 | NumAromaticRings: | 0 |
