Glycoside
GD036181
Name:
NoneFormula:
C17H27O8NSSmiles:
CO[C@@H]1O[C@H]([C@H](O)CNS(=O)(=O)c2c(C)cc(C)cc2C)[C@H](O)[C@H](O)[C@H]1OAglycone:
Cc1cc(C)c(S(=O)(=O)NCCO)c(C)c1Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -1.29 | Num_rotatable_bonds: | 6 |
| MolWt: | 405.47 | Num_heavy_atoms: | 27 |
| TPSA: | 145.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD22846
Formula: C11H17O3NS
Smiles:
Cc1cc(C)c(S(=O)(=O)NCCO)c(C)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.45 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 4 |
| MolWt: | 243.33 | Num_heavy_atoms: | 16 |
| TPSA: | 66.4 | NumAromaticRings: | 1 |
