Glycoside
GD128913
Name:
5-ethenyl-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-octahydropyrano[3,4-c]pyran-1-oneFormula:
C16H24O9Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OCC2C(=O)OCCC21Aglycone:
C=CC1C(O)OCC2C(=O)OCCC21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | -1.86 | Num_rotatable_bonds: | 4 |
| MolWt: | 360.36 | Num_heavy_atoms: | 25 |
| TPSA: | 134.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD52217
Formula: C10H14O4
Smiles:
C=CC1C(O)OCC2C(=O)OCCC21| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.7 |
| AlogP: | 0.32 | Num_rotatable_bonds: | 1 |
| MolWt: | 198.22 | Num_heavy_atoms: | 14 |
| TPSA: | 55.76 | NumAromaticRings: | 0 |
