Glycoside
GD090899
Name:
NoneFormula:
C19H30O8N2SSmiles:
CC(C)N(CC(=O)NCCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O)S(=O)(=O)c1ccccc1Aglycone:
CC(C)N(CC(=O)NCCO)S(=O)(=O)c1ccccc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.63 |
| AlogP: | -0.95 | Num_rotatable_bonds: | 9 |
| MolWt: | 446.52 | Num_heavy_atoms: | 30 |
| TPSA: | 145.63 | NumAromaticRings: | 1 |
Unique Aglycone
AD39576
Formula: C13H20O4N2S
Smiles:
CC(C)N(CC(=O)NCCO)S(=O)(=O)c1ccccc1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.46 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 7 |
| MolWt: | 300.38 | Num_heavy_atoms: | 20 |
| TPSA: | 86.71 | NumAromaticRings: | 1 |
