Glycoside
GD012227
Name:
NoneFormula:
C28H48O7N4Smiles:
CCCCCCCCCCCCCC(=O)N[C@H](C(=O)Nc1ccn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)n1)C(C)CAglycone:
CCCCCCCCCCCCCC(=O)NC(C(=O)Nc1cc[nH]c(=O)n1)C(C)CSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.79 |
| AlogP: | 2.64 | Num_rotatable_bonds: | 18 |
| MolWt: | 552.71 | Num_heavy_atoms: | 39 |
| TPSA: | 163.01 | NumAromaticRings: | 1 |
Unique Aglycone
AD09233
Formula: C23H40O3N4
Smiles:
CCCCCCCCCCCCCC(=O)NC(C(=O)Nc1cc[nH]c(=O)n1)C(C)C| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.74 |
| AlogP: | 4.55 | Num_rotatable_bonds: | 16 |
| MolWt: | 420.6 | Num_heavy_atoms: | 30 |
| TPSA: | 103.95 | NumAromaticRings: | 1 |
