Glycoside
GD050372
Name:
NoneFormula:
C14H27O6N2Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@@H]2CCC[C@H]2[NH3+])[C@@H](O)[C@H](O)[C@@H]1OAglycone:
[NH3+]C1CCCC1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.93 |
| AlogP: | -2.64 | Num_rotatable_bonds: | 5 |
| MolWt: | 319.38 | Num_heavy_atoms: | 22 |
| TPSA: | 135.89 | NumAromaticRings: | 0 |
Unique Aglycone
AD26613
Formula: C8H17O2N2
Smiles:
[NH3+]C1CCCC1C(=O)NCCO| HBA: | 4 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.88 |
| AlogP: | -1.49 | Num_rotatable_bonds: | 3 |
| MolWt: | 173.24 | Num_heavy_atoms: | 12 |
| TPSA: | 76.97 | NumAromaticRings: | 0 |
