Glycoside
GD092135
Name:
NoneFormula:
C20H33O7N2SSmiles:
Cc1ccc(S(=O)(=O)N2CCC([NH2+]CCO[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)CC2)cc1Aglycone:
Cc1ccc(S(=O)(=O)N2CCC([NH2+]CCO)CC2)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.7 |
| AlogP: | -1.44 | Num_rotatable_bonds: | 7 |
| MolWt: | 445.56 | Num_heavy_atoms: | 30 |
| TPSA: | 133.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD40226
Formula: C14H23O3N2S
Smiles:
Cc1ccc(S(=O)(=O)N2CCC([NH2+]CCO)CC2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.57 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 5 |
| MolWt: | 299.42 | Num_heavy_atoms: | 20 |
| TPSA: | 74.22 | NumAromaticRings: | 1 |
