Glycoside
GD079199
Name:
NoneFormula:
C13H20O7N6PSmiles:
CN1[NH+]=C(N)c2cn([C@H]3O[C@@H](CO[PH](O)(O)O)[C@@H](O)[C@H]3O)c3ncnc1c23Aglycone:
CN1[NH+]=C(N)C2=C[N]c3ncnc1c32.CO[PH](O)(O)OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.46 |
| AlogP: | -4.4 | Num_rotatable_bonds: | 4 |
| MolWt: | 403.31 | Num_heavy_atoms: | 27 |
| TPSA: | 193.55 | NumAromaticRings: | 2 |
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 |
AD25414
Formula: C8H8N6
Smiles:
CN1[NH+]=C(N)C2=C[N]c3ncnc1c32| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | -2.13 | Num_rotatable_bonds: | 0 |
| MolWt: | 188.19 | Num_heavy_atoms: | 14 |
| TPSA: | 83.11 | NumAromaticRings: | 1 |
