Glycoside
GD030200
Name:
NoneFormula:
C15H18O6N2SSmiles:
O=C(C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)Nc1nc2ccccc2s1Aglycone:
CC(=O)Nc1nc2ccccc2s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -0.53 | Num_rotatable_bonds: | 4 |
| MolWt: | 354.38 | Num_heavy_atoms: | 24 |
| TPSA: | 132.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD19553
Formula: C9H8ON2S
Smiles:
CC(=O)Nc1nc2ccccc2s1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 2.25 | Num_rotatable_bonds: | 1 |
| MolWt: | 192.24 | Num_heavy_atoms: | 13 |
| TPSA: | 41.99 | NumAromaticRings: | 2 |
