Glycoside
GD124377
Name:
2-{[3,5-dihydroxy-6-(hydroxymethyl)-4-(propan-2-yloxy)oxan-2-yl]oxy}-2-methylbutanenitrileFormula:
C14H25O6NSmiles:
CCC(C)(C#N)OC1OC(CO)C(O)C(OC(C)C)C1OAglycone:
CCC(C)(O)C#NSugarmoiety:
CC(C)OC1C(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.93 |
| AlogP: | -0.07 | Num_rotatable_bonds: | 6 |
| MolWt: | 303.36 | Num_heavy_atoms: | 21 |
| TPSA: | 112.17 | NumAromaticRings: | 0 |
Unique Aglycone
AD25066
Formula: C5H9ON
Smiles:
CCC(C)(O)C#N| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 1 |
| MolWt: | 99.13 | Num_heavy_atoms: | 7 |
| TPSA: | 44.02 | NumAromaticRings: | 0 |
