Glycoside
GD112612
Name:
NoneFormula:
C36H58O11N4Smiles:
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)CCCCCc1ccc([N+](=O)[O-])c2nonc12Aglycone:
CCCCCCCCCCCCCC=CC(O)C(CO)NC(=O)CCCCCc1ccc([N+](=O)[O-])c2nonc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.75 |
| AlogP: | 4.15 | Num_rotatable_bonds: | 26 |
| MolWt: | 722.88 | Num_heavy_atoms: | 51 |
| TPSA: | 230.77 | NumAromaticRings: | 2 |
Unique Aglycone
AD44785
Formula: C30H48O6N4
Smiles:
CCCCCCCCCCCCCC=CC(O)C(CO)NC(=O)CCCCCc1ccc([N+](=O)[O-])c2nonc12| HBA: | 10 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.7 |
| AlogP: | 6.33 | Num_rotatable_bonds: | 23 |
| MolWt: | 560.74 | Num_heavy_atoms: | 40 |
| TPSA: | 151.62 | NumAromaticRings: | 2 |
