Glycoside
GD041592
Name:
NoneFormula:
C8H11O6N3Smiles:
O=c1cnn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)[nH]1Aglycone:
O=c1cn[nH]c(=O)[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -3.46 | Num_rotatable_bonds: | 2 |
| MolWt: | 245.19 | Num_heavy_atoms: | 17 |
| TPSA: | 137.67 | NumAromaticRings: | 1 |
Unique Aglycone
AD07645
Formula: C3H3O2N3
Smiles:
O=c1cn[nH]c(=O)[nH]1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -1.54 | Num_rotatable_bonds: | 0 |
| MolWt: | 113.08 | Num_heavy_atoms: | 8 |
| TPSA: | 78.61 | NumAromaticRings: | 1 |
