Glycoside
GD076430
Name:
NoneFormula:
C14H21O8N3SSmiles:
N#CCS(=O)(=O)N1CC[C@H]2CN(C(=O)[C@H]3O[C@@H](O)[C@H](O)[C@@H](O)[C@H]3O)C[C@H]21Aglycone:
N#CCS(=O)(=O)N1CCC2CN(C=O)CC21Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.86 |
| AlogP: | -3.83 | Num_rotatable_bonds: | 3 |
| MolWt: | 391.4 | Num_heavy_atoms: | 26 |
| TPSA: | 171.63 | NumAromaticRings: | 0 |
Unique Aglycone
AD35244
Formula: C9H13O3N3S
Smiles:
N#CCS(=O)(=O)N1CCC2CN(C=O)CC21| HBA: | 6 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.78 |
| AlogP: | -1.0 | Num_rotatable_bonds: | 3 |
| MolWt: | 243.29 | Num_heavy_atoms: | 16 |
| TPSA: | 81.48 | NumAromaticRings: | 0 |
