Glycoside
GD039205
Name:
5-fluoro-1-[3-c-(hydroxymethyl)-beta-d-glucopyranosyl]pyrimidine-2,4(1h,3h)-dioneFormula:
C11H15O8N2FSmiles:
O=c1[nH]c(=O)n([C@H]2O[C@H](CO)[C@H](O)[C@](O)(CO)[C@@H]2O)cc1FAglycone:
O=c1[nH]cc(F)c(=O)[nH]1Sugarmoiety:
OCC1OC(O)C(O)C(O)(CO)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.64 |
| AlogP: | -3.99 | Num_rotatable_bonds: | 3 |
| MolWt: | 322.25 | Num_heavy_atoms: | 22 |
| TPSA: | 165.24 | NumAromaticRings: | 1 |
Unique Aglycone
AD01634
Formula: C4H3O2N2F
Smiles:
O=c1[nH]cc(F)c(=O)[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.8 | Num_rotatable_bonds: | 0 |
| MolWt: | 130.08 | Num_heavy_atoms: | 9 |
| TPSA: | 65.72 | NumAromaticRings: | 1 |
