Glycoside
GD070497
Name:
NoneFormula:
C18H30O5NSSmiles:
Cc1ccc(SC[C@@H](C)[NH2+]CCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)cc1Aglycone:
Cc1ccc(SCC(C)[NH2+]CCO)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 8 |
| MolWt: | 372.51 | Num_heavy_atoms: | 25 |
| TPSA: | 95.76 | NumAromaticRings: | 1 |
Unique Aglycone
AD33420
Formula: C12H20ONS
Smiles:
Cc1ccc(SCC(C)[NH2+]CCO)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 1.03 | Num_rotatable_bonds: | 6 |
| MolWt: | 226.36 | Num_heavy_atoms: | 15 |
| TPSA: | 36.84 | NumAromaticRings: | 1 |
