Glycoside
GD082373
Name:
NoneFormula:
C15H22O9N2SSmiles:
COC(=O)c1cncc(S(=O)(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)c1Aglycone:
COC(=O)c1cncc(S(=O)(=O)NCCO)c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 7 |
| MolWt: | 406.41 | Num_heavy_atoms: | 27 |
| TPSA: | 164.51 | NumAromaticRings: | 1 |
Unique Aglycone
AD37014
Formula: C9H12O5N2S
Smiles:
COC(=O)c1cncc(S(=O)(=O)NCCO)c1| HBA: | 7 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | -0.86 | Num_rotatable_bonds: | 5 |
| MolWt: | 260.27 | Num_heavy_atoms: | 17 |
| TPSA: | 105.59 | NumAromaticRings: | 1 |
