Glycoside
GD000477
Name:
NoneFormula:
C11H14O3N8SSmiles:
CSC[C@@H]1O[C@H](n2cnc3c(N)nc(N=[N+]=[N-])nc32)[C@H](O)[C@H]1OAglycone:
[N-]=[N+]=Nc1nc(N)c2c(n1)[N]C=N2Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | 0.33 | Num_rotatable_bonds: | 4 |
| MolWt: | 338.35 | Num_heavy_atoms: | 23 |
| TPSA: | 168.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD00533
Formula: C5H3N8
Smiles:
[N-]=[N+]=Nc1nc(N)c2c(n1)[N]C=N2| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 1 |
| MolWt: | 175.14 | Num_heavy_atoms: | 13 |
| TPSA: | 127.02 | NumAromaticRings: | 1 |
