Glycoside
GD004811
Name:
NoneFormula:
C12H15O4N3SSmiles:
CSc1nccc2c1ncn2C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CSc1nccc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 3 |
| MolWt: | 297.34 | Num_heavy_atoms: | 20 |
| TPSA: | 100.63 | NumAromaticRings: | 2 |
Unique Aglycone
AD04156
Formula: C7H6N3S
Smiles:
CSc1nccc2c1N=C[N]2| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.14 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 1 |
| MolWt: | 164.21 | Num_heavy_atoms: | 11 |
| TPSA: | 39.35 | NumAromaticRings: | 1 |
