Glycoside
GD095040
Name:
NoneFormula:
C18H28O10N2SSmiles:
O=C(C(=O)N1C[C@H]2[C@@H](C1)S(=O)(=O)CC[C@H]2C(=O)N1CCOCC1)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
O=C(C1CCS(=O)(=O)C2CNCC12)N1CCOCC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.83 |
| AlogP: | -4.25 | Num_rotatable_bonds: | 6 |
| MolWt: | 464.49 | Num_heavy_atoms: | 31 |
| TPSA: | 181.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD40602
Formula: C12H20O4N2S
Smiles:
O=C(C1CCS(=O)(=O)C2CNCC12)N1CCOCC1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.92 |
| AlogP: | -1.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 288.37 | Num_heavy_atoms: | 19 |
| TPSA: | 75.71 | NumAromaticRings: | 0 |
