Glycoside
GD045526
Name:
NoneFormula:
C12H17O4N4Smiles:
C[C@]1(O)[C@@H](O)[C@@H](CO)O[C@@H]1n1ccc2c(N)[nH+]cnc21Aglycone:
Nc1[nH+]cnc2c1C=C[N]2Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -1.57 | Num_rotatable_bonds: | 2 |
| MolWt: | 281.29 | Num_heavy_atoms: | 20 |
| TPSA: | 127.9 | NumAromaticRings: | 2 |
Unique Aglycone
AD24858
Formula: C6H6N4
Smiles:
Nc1[nH+]cnc2c1C=C[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.14 | Num_heavy_atoms: | 10 |
| TPSA: | 67.15 | NumAromaticRings: | 1 |
