Glycoside
GD038369
Name:
1-deoxy-1-{5-[(1s)-2-fluoro-1-hydroxyethyl]-7,8-dimethyl-2,4-dioxo-1,3,4,5-tetrahydrobenzo[g]pteridin-10(2h)-yl}-5-o-phosphono-d-ribitolFormula:
C19H26O10N4FPSmiles:
Cc1cc2c(cc1C)N([C@@H](O)CF)c1c([nH]c(=O)[nH]c1=O)N2C[C@@H](O)[C@@H](O)[C@@H](O)COP(=O)(O)OAglycone:
Cc1cc2c(cc1C)N(C(O)CF)c1c([nH]c(=O)[nH]c1=O)N2CSugarmoiety:
O=P(O)(O)OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.47 |
| AlogP: | -1.25 | Num_rotatable_bonds: | 9 |
| MolWt: | 520.41 | Num_heavy_atoms: | 35 |
| TPSA: | 219.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD23992
Formula: C15H17O3N4F
Smiles:
Cc1cc2c(cc1C)N(C(O)CF)c1c([nH]c(=O)[nH]c1=O)N2C| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 2 |
| MolWt: | 320.32 | Num_heavy_atoms: | 23 |
| TPSA: | 92.43 | NumAromaticRings: | 2 |
