Glycoside
GD022200
Name:
2-(1H-1,2,3-benzotriazol-1-yl)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C12H15O5N3Smiles:
OCC1OC(n2nnc3ccccc32)C(O)C(O)C1OAglycone:
c1ccc2c(c1)[N]N=N2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.6 | Num_rotatable_bonds: | 2 |
| MolWt: | 281.27 | Num_heavy_atoms: | 20 |
| TPSA: | 120.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD15084
Formula: C6H4N3
Smiles:
c1ccc2c(c1)[N]N=N2| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 0 |
| MolWt: | 118.12 | Num_heavy_atoms: | 9 |
| TPSA: | 38.82 | NumAromaticRings: | 1 |
