Glycoside
GD027190
Name:
NoneFormula:
C14H17O4N7SSmiles:
CSc1nc(N)c2c3c(N)ncnc3n(C3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
CSc1nc(N)c2c(n1)[N]c1ncnc(N)c1-2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.43 |
| AlogP: | -1.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 379.4 | Num_heavy_atoms: | 26 |
| TPSA: | 178.45 | NumAromaticRings: | 3 |
Unique Aglycone
AD17894
Formula: C9H8N7S
Smiles:
CSc1nc(N)c2c(n1)[N]c1ncnc(N)c1-2| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.11 |
| AlogP: | 0.7 | Num_rotatable_bonds: | 1 |
| MolWt: | 246.28 | Num_heavy_atoms: | 17 |
| TPSA: | 117.7 | NumAromaticRings: | 2 |
