Glycoside
GD041833
Name:
NoneFormula:
C7H11O6N3Smiles:
O=c1[nH]nc([C@H](O)[C@H](O)[C@@H](O)CO)c(=O)[nH]1Aglycone:
O=c1cn[nH]c(=O)[nH]1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.57 |
| AlogP: | -3.79 | Num_rotatable_bonds: | 4 |
| MolWt: | 233.18 | Num_heavy_atoms: | 16 |
| TPSA: | 159.53 | 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 |
