Glycoside
GD003484
Name:
1-[5-(1,2,3,4-tetrahydroxybutyl)pyrazin-2-yl]butane-1,2,3,4-tetrolFormula:
C12H20O8N2Smiles:
OC[C@H](O)[C@H](O)[C@H](O)c1cnc([C@H](O)[C@H](O)[C@H](O)CO)cn1Aglycone:
c1cnccn1Sugarmoiety:
OCC(O)C(O)C(O)O.OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.67 |
| AlogP: | -4.03 | Num_rotatable_bonds: | 8 |
| MolWt: | 320.3 | Num_heavy_atoms: | 22 |
| TPSA: | 187.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD03172
Formula: C4H4N2
Smiles:
c1cnccn1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 0.48 | Num_rotatable_bonds: | 0 |
| MolWt: | 80.09 | Num_heavy_atoms: | 6 |
| TPSA: | 25.78 | NumAromaticRings: | 1 |
