Glycoside
GD158037
Name:
1-(4-fluorophenyl)-5-({[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]amino}methylidene)-1,3-diazinane-2,4,6-trioneFormula:
C17H18O8N3FSmiles:
O=C1N=C(O)C(=CNC2C(O)OC(CO)C(O)C2O)C(=O)N1c1ccc(F)cc1Aglycone:
NC=C1C(=O)N(c2ccc(F)cc2)C(=O)N=C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | -1.48 | Num_rotatable_bonds: | 4 |
| MolWt: | 411.34 | Num_heavy_atoms: | 29 |
| TPSA: | 172.15 | NumAromaticRings: | 1 |
Unique Aglycone
AD62411
Formula: C11H8O3N3F
Smiles:
NC=C1C(=O)N(c2ccc(F)cc2)C(=O)N=C1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 1.09 | Num_rotatable_bonds: | 1 |
| MolWt: | 249.2 | Num_heavy_atoms: | 18 |
| TPSA: | 95.99 | NumAromaticRings: | 1 |
