Glycoside
GD138839
Name:
tridec-12-en-4,6-diyne-2,8,9,10,11-pentolFormula:
C13H18O5Smiles:
C=CC(O)C(O)C(O)C(O)C#CC#CCC(C)OAglycone:
C#CC#CCC(C)OSugarmoiety:
C=CC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -1.61 | Num_rotatable_bonds: | 5 |
| MolWt: | 254.28 | Num_heavy_atoms: | 18 |
| TPSA: | 101.15 | NumAromaticRings: | 0 |
Unique Aglycone
AD56015
Formula: C7H8O
Smiles:
C#CC#CCC(C)O| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.43 |
| AlogP: | 0.39 | Num_rotatable_bonds: | 1 |
| MolWt: | 108.14 | Num_heavy_atoms: | 8 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
