Glycoside
GD010237
Name:
NoneFormula:
C20H26O11N2S2Smiles:
COC(=O)[C@@H]1O[C@H](SNCc2ccc(S(N)(=O)=O)cc2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=OAglycone:
NS(=O)(=O)c1ccc(CNS)cc1Sugarmoiety:
COC(=O)C1OC(O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 9 |
| MolWt: | 534.57 | Num_heavy_atoms: | 35 |
| TPSA: | 186.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD02188
Formula: C7H10O2N2S2
Smiles:
NS(=O)(=O)c1ccc(CNS)cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.14 |
| AlogP: | 0.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 218.3 | Num_heavy_atoms: | 13 |
| TPSA: | 72.19 | NumAromaticRings: | 1 |
