Glycoside
GD012322
Name:
NoneFormula:
C36H64O9N2Smiles:
CCCCCCCCCCCCCC[C@H](O)[C@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)NCCCCCc1ccccc1Aglycone:
CCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)NCCCCCc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.81 |
| AlogP: | 3.7 | Num_rotatable_bonds: | 26 |
| MolWt: | 668.91 | Num_heavy_atoms: | 47 |
| TPSA: | 180.97 | NumAromaticRings: | 1 |
Unique Aglycone
AD09309
Formula: C30H54O4N2
Smiles:
CCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)NCCCCCc1ccccc1| HBA: | 6 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.77 |
| AlogP: | 5.87 | Num_rotatable_bonds: | 23 |
| MolWt: | 506.77 | Num_heavy_atoms: | 36 |
| TPSA: | 101.82 | NumAromaticRings: | 1 |
