Glycoside
GD067305
Name:
NoneFormula:
C11H15O7N5SSmiles:
N#CCS(=O)(=O)Nc1c(C(N)=O)ncn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
N#CCS(=O)(=O)NC1=C(C(N)=O)N=C[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.55 |
| AlogP: | -3.14 | Num_rotatable_bonds: | 6 |
| MolWt: | 361.34 | Num_heavy_atoms: | 24 |
| TPSA: | 200.79 | NumAromaticRings: | 1 |
Unique Aglycone
AD32123
Formula: C6H6O3N5S
Smiles:
N#CCS(=O)(=O)NC1=C(C(N)=O)N=C[N]1| HBA: | 8 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | -2.27 | Num_rotatable_bonds: | 4 |
| MolWt: | 228.21 | Num_heavy_atoms: | 15 |
| TPSA: | 139.51 | NumAromaticRings: | 0 |
