Glycoside
GD066916
Name:
NoneFormula:
C17H29O6N2Smiles:
CC/C=C\CC[NH+]1CC2(CN(C(=O)[C@H]3O[C@H](O)[C@H](O)[C@@H](O)[C@H]3O)C2)C1Aglycone:
CCC=CCC[NH+]1CC2(CN(C=O)C2)C1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.82 |
| AlogP: | -3.13 | Num_rotatable_bonds: | 5 |
| MolWt: | 357.43 | Num_heavy_atoms: | 25 |
| TPSA: | 114.9 | NumAromaticRings: | 0 |
Unique Aglycone
AD31986
Formula: C12H21ON2
Smiles:
CCC=CCC[NH+]1CC2(CN(C=O)C2)C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 5 |
| MolWt: | 209.31 | Num_heavy_atoms: | 15 |
| TPSA: | 24.75 | NumAromaticRings: | 0 |
