Glycoside
GD005865
Name:
NoneFormula:
C11H17O7N3SSmiles:
CCS(=O)(=O)c1c(C(N)=O)ncn1C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CCS(=O)(=O)C1=C(C(N)=O)N=C[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -2.61 | Num_rotatable_bonds: | 5 |
| MolWt: | 335.34 | Num_heavy_atoms: | 22 |
| TPSA: | 164.97 | NumAromaticRings: | 1 |
Unique Aglycone
AD04916
Formula: C6H8O3N3S
Smiles:
CCS(=O)(=O)C1=C(C(N)=O)N=C[N]1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | -1.28 | Num_rotatable_bonds: | 3 |
| MolWt: | 202.22 | Num_heavy_atoms: | 13 |
| TPSA: | 103.69 | NumAromaticRings: | 0 |
