Glycoside
GD098923
Name:
NoneFormula:
C17H26O6N2ISmiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@@H]([NH3+])Cc2ccc(I)cc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
[NH3+]C(Cc1ccc(I)cc1)C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.59 |
| AlogP: | -1.6 | Num_rotatable_bonds: | 7 |
| MolWt: | 481.31 | Num_heavy_atoms: | 26 |
| TPSA: | 135.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD42090
Formula: C11H16O2N2I
Smiles:
[NH3+]C(Cc1ccc(I)cc1)C(=O)NCCO| HBA: | 4 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | -0.45 | Num_rotatable_bonds: | 5 |
| MolWt: | 335.17 | Num_heavy_atoms: | 16 |
| TPSA: | 76.97 | NumAromaticRings: | 1 |
