Glycoside
GD116453
Name:
ProacaciberinFormula:
C16H25O10NSmiles:
C=C(C)C(C#N)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1OAglycone:
C=C(C)C(O)C#NSugarmoiety:
OC1COC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.81 |
| AlogP: | -3.27 | Num_rotatable_bonds: | 6 |
| MolWt: | 391.37 | Num_heavy_atoms: | 27 |
| TPSA: | 182.09 | NumAromaticRings: | 0 |
Unique Aglycone
AD46243
Formula: C5H7ON
Smiles:
C=C(C)C(O)C#N| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 0.45 | Num_rotatable_bonds: | 1 |
| MolWt: | 97.12 | Num_heavy_atoms: | 7 |
| TPSA: | 44.02 | NumAromaticRings: | 0 |
