Glycoside
GD046390
Name:
NoneFormula:
C13H24O5N2Smiles:
CC[C@@H](CC#N)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
CCC(CC#N)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.92 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 7 |
| MolWt: | 288.34 | Num_heavy_atoms: | 20 |
| TPSA: | 114.97 | NumAromaticRings: | 0 |
Unique Aglycone
AD25379
Formula: C7H14ON2
Smiles:
CCC(CC#N)NCCO| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.86 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 5 |
| MolWt: | 142.2 | Num_heavy_atoms: | 10 |
| TPSA: | 56.05 | NumAromaticRings: | 0 |
