Glycoside
GD041956
Name:
1-(5-methylpyrazin-2-yl)butane-1,2,3,4-tetrolFormula:
C9H14O4N2Smiles:
Cc1cnc([C@H](O)[C@H](O)[C@H](O)CO)cn1Aglycone:
Cc1cnccn1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 4 |
| MolWt: | 214.22 | Num_heavy_atoms: | 15 |
| TPSA: | 106.7 | NumAromaticRings: | 1 |
Unique Aglycone
AD24831
Formula: C5H6N2
Smiles:
Cc1cnccn1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.2 |
| AlogP: | 0.79 | Num_rotatable_bonds: | 0 |
| MolWt: | 94.12 | Num_heavy_atoms: | 7 |
| TPSA: | 25.78 | NumAromaticRings: | 1 |
