Glycoside
GD061528
Name:
NoneFormula:
C16H28O6NSmiles:
C[C@@H]1O[C@@H](OCC[NH2+][C@@H]2C[C@H]3CC(=O)C[C@H]3C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C1CC2CC([NH2+]CCO)CC2C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | -1.85 | Num_rotatable_bonds: | 5 |
| MolWt: | 330.4 | Num_heavy_atoms: | 23 |
| TPSA: | 112.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD30163
Formula: C10H18O2N
Smiles:
O=C1CC2CC([NH2+]CCO)CC2C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.9 |
| AlogP: | -0.7 | Num_rotatable_bonds: | 3 |
| MolWt: | 184.26 | Num_heavy_atoms: | 13 |
| TPSA: | 53.91 | NumAromaticRings: | 0 |
