Glycoside
GD075801
Name:
NoneFormula:
C17H31O6N2SSmiles:
CCSCC[NH+]1CCC2(CC1)CN(C(=O)[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O)C2Aglycone:
CCSCC[NH+]1CCC2(CC1)CN(C=O)C2Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | -2.95 | Num_rotatable_bonds: | 5 |
| MolWt: | 391.51 | Num_heavy_atoms: | 26 |
| TPSA: | 114.9 | NumAromaticRings: | 0 |
Unique Aglycone
AD35103
Formula: C12H23ON2S
Smiles:
CCSCC[NH+]1CCC2(CC1)CN(C=O)C2| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.92 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 5 |
| MolWt: | 243.4 | Num_heavy_atoms: | 16 |
| TPSA: | 24.75 | NumAromaticRings: | 0 |
