Glycoside
GD018813
Name:
NoneFormula:
C26H41O7N5Smiles:
CCCCCCCC(=O)Nc1nc2c(ncn2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2OC(=O)CCCCCCC)c(=O)[nH]1Aglycone:
CCCCCCCC(=O)Nc1nc2c(c(=O)[nH]1)N=C[N]2.CCCCCCCC(=O)OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.73 |
| AlogP: | 2.94 | Num_rotatable_bonds: | 16 |
| MolWt: | 535.64 | Num_heavy_atoms: | 38 |
| TPSA: | 168.66 | NumAromaticRings: | 2 |
Unique Aglycone
AD04095
Formula: C8H16O2
Smiles:
CCCCCCCC(=O)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.88 |
| AlogP: | 2.43 | Num_rotatable_bonds: | 6 |
| MolWt: | 144.21 | Num_heavy_atoms: | 10 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
AD13201
Formula: C13H18O2N5
Smiles:
CCCCCCCC(=O)Nc1nc2c(c(=O)[nH]1)N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.54 |
| AlogP: | 1.98 | Num_rotatable_bonds: | 7 |
| MolWt: | 276.32 | Num_heavy_atoms: | 20 |
| TPSA: | 101.31 | NumAromaticRings: | 1 |
