Glycoside
GD037037
Name:
NoneFormula:
C27H37O7N6FSSmiles:
O=C(NCCCCCCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O)c1ccc(S(=O)(=O)F)cc1Aglycone:
O=C(NCCCCCCCCCCNc1ncnc2c1N=C[N]2)c1ccc(S(=O)(=O)F)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | 2.06 | Num_rotatable_bonds: | 16 |
| MolWt: | 608.69 | Num_heavy_atoms: | 42 |
| TPSA: | 188.79 | NumAromaticRings: | 3 |
Unique Aglycone
AD23360
Formula: C22H28O3N6FS
Smiles:
O=C(NCCCCCCCCCCNc1ncnc2c1N=C[N]2)c1ccc(S(=O)(=O)F)cc1| HBA: | 9 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | 4.01 | Num_rotatable_bonds: | 14 |
| MolWt: | 475.57 | Num_heavy_atoms: | 33 |
| TPSA: | 127.51 | NumAromaticRings: | 2 |
