Glycoside
GD022969
Name:
NoneFormula:
C12H17O5N5Smiles:
C[C@H](O)[C@@H]1O[C@H](n2cnc3c(=O)[nH]c(N)nc32)[C@@](C)(O)[C@H]1OAglycone:
Nc1nc2c(c(=O)[nH]1)N=C[N]2Sugarmoiety:
CC(O)C1OC(O)C(C)(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | -1.91 | Num_rotatable_bonds: | 2 |
| MolWt: | 311.3 | Num_heavy_atoms: | 22 |
| TPSA: | 159.51 | NumAromaticRings: | 2 |
Unique Aglycone
AD00207
Formula: C5H4ON5
Smiles:
Nc1nc2c(c(=O)[nH]1)N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 0 |
| MolWt: | 150.12 | Num_heavy_atoms: | 11 |
| TPSA: | 98.23 | NumAromaticRings: | 1 |
