Glycoside
GD093566
Name:
NoneFormula:
C14H23O14NSSmiles:
CC(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@H](O)[C@@H]1O[C@@H]1OC(C(=O)O)=C[C@H](O)[C@H]1OS(O)(O)OAglycone:
O=C(O)C1=CC(O)C(OS(O)(O)O)C(O)O1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 0.71 |
| AlogP: | -2.84 | Num_rotatable_bonds: | 7 |
| MolWt: | 461.4 | Num_heavy_atoms: | 30 |
| TPSA: | 244.93 | NumAromaticRings: | 0 |
Unique Aglycone
AD40406
Formula: C6H10O9S
Smiles:
O=C(O)C1=CC(O)C(OS(O)(O)O)C(O)O1| HBA: | 9 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -0.81 | Num_rotatable_bonds: | 3 |
| MolWt: | 258.2 | Num_heavy_atoms: | 16 |
| TPSA: | 156.91 | NumAromaticRings: | 0 |
