Glycoside
GD095330
Name:
NoneFormula:
C17H26O10N2SSmiles:
COc1cc(S(N)(=O)=O)cc(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)c1OCAglycone:
COc1cc(S(N)(=O)=O)cc(C(=O)NCCO)c1OCSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.59 |
| AlogP: | -2.07 | Num_rotatable_bonds: | 8 |
| MolWt: | 450.47 | Num_heavy_atoms: | 30 |
| TPSA: | 186.87 | NumAromaticRings: | 1 |
Unique Aglycone
AD40686
Formula: C11H16O6N2S
Smiles:
COc1cc(S(N)(=O)=O)cc(C(=O)NCCO)c1OC| HBA: | 8 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.36 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 6 |
| MolWt: | 304.32 | Num_heavy_atoms: | 20 |
| TPSA: | 127.95 | NumAromaticRings: | 1 |
