Glycoside
GD057582
Name:
NoneFormula:
C13H19O6N3SSmiles:
Cc1ccnc(SCC(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)n1Aglycone:
Cc1ccnc(SCC(N)=O)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -2.21 | Num_rotatable_bonds: | 5 |
| MolWt: | 345.38 | Num_heavy_atoms: | 23 |
| TPSA: | 145.03 | NumAromaticRings: | 1 |
Unique Aglycone
AD28888
Formula: C7H9ON3S
Smiles:
Cc1ccnc(SCC(N)=O)n1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 3 |
| MolWt: | 183.24 | Num_heavy_atoms: | 12 |
| TPSA: | 68.87 | NumAromaticRings: | 1 |
