Glycoside
GD082667
Name:
NoneFormula:
C18H28O7N2SSmiles:
Cc1ccc(S(=O)(=O)N2CCC(N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)CC2)cc1Aglycone:
Cc1ccc(S(=O)(=O)N2CCC(N)CC2)cc1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -1.62 | Num_rotatable_bonds: | 9 |
| MolWt: | 416.5 | Num_heavy_atoms: | 28 |
| TPSA: | 147.4 | NumAromaticRings: | 1 |
Unique Aglycone
AD37094
Formula: C12H18O2N2S
Smiles:
Cc1ccc(S(=O)(=O)N2CCC(N)CC2)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.11 | Num_rotatable_bonds: | 2 |
| MolWt: | 254.35 | Num_heavy_atoms: | 17 |
| TPSA: | 63.4 | NumAromaticRings: | 1 |
