Glycoside
GD100579
Name:
NoneFormula:
C19H22O8N5PSmiles:
O=C1CCc2cc(Nc3ncnc4c3ncn4[C@@H]3O[C@H](CO[PH](O)(O)O)[C@@H](O)[C@H]3O)ccc21Aglycone:
CO[PH](O)(O)O.O=C1CCc2cc(Nc3ncnc4c3N=C[N]4)ccc21Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.37 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 6 |
| MolWt: | 479.39 | Num_heavy_atoms: | 33 |
| TPSA: | 192.31 | NumAromaticRings: | 3 |
Unique Aglycone
AD01852
Formula: CH7O4P
Smiles:
CO[PH](O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 1 |
| MolWt: | 114.04 | Num_heavy_atoms: | 6 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
AD35960
Formula: C14H10ON5
Smiles:
O=C1CCc2cc(Nc3ncnc4c3N=C[N]4)ccc21| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 2.26 | Num_rotatable_bonds: | 2 |
| MolWt: | 264.27 | Num_heavy_atoms: | 20 |
| TPSA: | 81.34 | NumAromaticRings: | 2 |
