Glycoside
GD154858
Name:
Supinanitriloside AFormula:
C11H19O6NSmiles:
CCC(C#N)COC1OC(CO)C(O)C(O)C1OAglycone:
CCC(C#N)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.91 |
| AlogP: | -1.65 | Num_rotatable_bonds: | 5 |
| MolWt: | 261.27 | Num_heavy_atoms: | 18 |
| TPSA: | 123.17 | NumAromaticRings: | 0 |
Unique Aglycone
AD57376
Formula: C5H9ON
Smiles:
CCC(C#N)CO| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 0.53 | Num_rotatable_bonds: | 2 |
| MolWt: | 99.13 | Num_heavy_atoms: | 7 |
| TPSA: | 44.02 | NumAromaticRings: | 0 |
