Glycoside
GD072223
Name:
NoneFormula:
C15H23O9NSSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccccc2S(O)(O)O)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1ccccc1S(O)(O)OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.53 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 6 |
| MolWt: | 393.41 | Num_heavy_atoms: | 26 |
| TPSA: | 168.94 | NumAromaticRings: | 1 |
Unique Aglycone
AD33777
Formula: C9H13O5NS
Smiles:
O=C(NCCO)c1ccccc1S(O)(O)O| HBA: | 6 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.22 |
| AlogP: | 0.99 | Num_rotatable_bonds: | 4 |
| MolWt: | 247.27 | Num_heavy_atoms: | 16 |
| TPSA: | 110.02 | NumAromaticRings: | 1 |
