Glycoside
GD082330
Name:
NoneFormula:
C16H24O8N2SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cccnc2CS(C)(=O)=O)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CS(=O)(=O)Cc1ncccc1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -1.8 | Num_rotatable_bonds: | 7 |
| MolWt: | 404.44 | Num_heavy_atoms: | 27 |
| TPSA: | 155.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD36985
Formula: C10H14O4N2S
Smiles:
CS(=O)(=O)Cc1ncccc1C(=O)NCCO| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 5 |
| MolWt: | 258.3 | Num_heavy_atoms: | 17 |
| TPSA: | 96.36 | NumAromaticRings: | 1 |
