Glycoside
GD063429
Name:
NoneFormula:
C16H29O7N2Smiles:
O=C(N[C@H]1CC[C@H]([NH+]2CCOCC2)CC1)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
NC1CCC([NH+]2CCOCC2)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | -4.03 | Num_rotatable_bonds: | 7 |
| MolWt: | 361.42 | Num_heavy_atoms: | 25 |
| TPSA: | 140.76 | NumAromaticRings: | 0 |
Unique Aglycone
AD30552
Formula: C10H21ON2
Smiles:
NC1CCC([NH+]2CCOCC2)CC1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 1 |
| MolWt: | 185.29 | Num_heavy_atoms: | 13 |
| TPSA: | 39.69 | NumAromaticRings: | 0 |
