Glycoside
GD119661
Name:
2-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)prop-2-enenitrileFormula:
C10H15O6NSmiles:
C=C(C#N)COC1OC(CO)C(O)C(O)C1OAglycone:
C=C(C#N)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.7 |
| AlogP: | -2.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 245.23 | Num_heavy_atoms: | 17 |
| TPSA: | 123.17 | NumAromaticRings: | 0 |
Unique Aglycone
AD47984
Formula: C4H5ON
Smiles:
C=C(C#N)CO| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 0.06 | Num_rotatable_bonds: | 1 |
| MolWt: | 83.09 | Num_heavy_atoms: | 6 |
| TPSA: | 44.02 | NumAromaticRings: | 0 |
