Glycoside
GD112586
Name:
NoneFormula:
C36H59O11N5Smiles:
CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)CCCCCNc1ccc([N+](=O)[O-])c2nonc12Aglycone:
CCCCCCCCCCCCCC=CC(O)C(CO)NC(=O)CCCCCNc1ccc([N+](=O)[O-])c2nonc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.75 |
| AlogP: | 4.02 | Num_rotatable_bonds: | 27 |
| MolWt: | 737.89 | Num_heavy_atoms: | 52 |
| TPSA: | 242.8 | NumAromaticRings: | 2 |
Unique Aglycone
AD44783
Formula: C30H49O6N5
Smiles:
CCCCCCCCCCCCCC=CC(O)C(CO)NC(=O)CCCCCNc1ccc([N+](=O)[O-])c2nonc12| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.7 |
| AlogP: | 6.2 | Num_rotatable_bonds: | 24 |
| MolWt: | 575.75 | Num_heavy_atoms: | 41 |
| TPSA: | 163.65 | NumAromaticRings: | 2 |
