Glycoside
GD103409
Name:
NoneFormula:
C22H41O9N2Smiles:
C[C@@H]1O[C@@H](OCC[NH2+][C@H]2C[C@@H](C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)C1CC([NH2+]CCO)CN1C(=O)OC(C)(C)CSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.91 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 6 |
| MolWt: | 477.58 | Num_heavy_atoms: | 33 |
| TPSA: | 151.6 | NumAromaticRings: | 0 |
Unique Aglycone
AD43772
Formula: C16H31O5N2
Smiles:
CC(C)(C)OC(=O)C1CC([NH2+]CCO)CN1C(=O)OC(C)(C)C| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.88 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 331.43 | Num_heavy_atoms: | 23 |
| TPSA: | 92.68 | NumAromaticRings: | 0 |
