Glycoside
GD094644
Name:
NoneFormula:
C18H29O9N5SSmiles:
CC(C)(C)OC(=O)N1CC[C@@H](S(=O)(=O)Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1Aglycone:
CC(C)(C)OC(=O)N1CCC(S(=O)(=O)NC2=C(C(N)=O)N=C[N]2)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.72 |
| AlogP: | -1.66 | Num_rotatable_bonds: | 6 |
| MolWt: | 491.52 | Num_heavy_atoms: | 33 |
| TPSA: | 206.54 | NumAromaticRings: | 1 |
Unique Aglycone
AD40535
Formula: C13H20O5N5S
Smiles:
CC(C)(C)OC(=O)N1CCC(S(=O)(=O)NC2=C(C(N)=O)N=C[N]2)C1| HBA: | 10 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.62 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 4 |
| MolWt: | 358.4 | Num_heavy_atoms: | 24 |
| TPSA: | 145.26 | NumAromaticRings: | 0 |
