Glycoside
GD026443
Name:
FAICARFormula:
C10H15O9N4PSmiles:
NC(=O)c1ncn([C@@H]2O[C@H](COP(=O)(O)O)[C@H](O)[C@H]2O)c1NC=OAglycone:
COP(=O)(O)O.NC(=O)C1=C(NC=O)[N]C=N1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -2.72 | Num_rotatable_bonds: | 7 |
| MolWt: | 366.22 | Num_heavy_atoms: | 24 |
| TPSA: | 206.46 | NumAromaticRings: | 1 |
Unique Aglycone
AD00079
Formula: CH5O4P
Smiles:
COP(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.02 | Num_heavy_atoms: | 6 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
AD16702
Formula: C5H5O2N4
Smiles:
NC(=O)C1=C(NC=O)[N]C=N1| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -1.97 | Num_rotatable_bonds: | 3 |
| MolWt: | 153.12 | Num_heavy_atoms: | 11 |
| TPSA: | 98.65 | NumAromaticRings: | 0 |
