Glycoside
GD061928
Name:
NoneFormula:
C16H29O5N2Smiles:
C[C@@H]1O[C@@H](OCC[NH2+][C@H]2CC[C@@H](CC#N)CC2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
N#CCC1CCC([NH2+]CCO)CC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | -1.13 | Num_rotatable_bonds: | 6 |
| MolWt: | 329.42 | Num_heavy_atoms: | 23 |
| TPSA: | 119.55 | NumAromaticRings: | 0 |
Unique Aglycone
AD30266
Formula: C10H19ON2
Smiles:
N#CCC1CCC([NH2+]CCO)CC1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.9 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 183.27 | Num_heavy_atoms: | 13 |
| TPSA: | 60.63 | NumAromaticRings: | 0 |
