Glycoside
GD064095
Name:
NoneFormula:
C12H21O7N3SSmiles:
C[C@@H]1O[C@@H](OCCNS(=O)(=O)c2cnn(C)c2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
Cn1cc(S(=O)(=O)NCCO)cn1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.75 |
| AlogP: | -2.46 | Num_rotatable_bonds: | 6 |
| MolWt: | 351.38 | Num_heavy_atoms: | 23 |
| TPSA: | 143.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD30834
Formula: C6H11O3N3S
Smiles:
Cn1cc(S(=O)(=O)NCCO)cn1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | -1.31 | Num_rotatable_bonds: | 4 |
| MolWt: | 205.24 | Num_heavy_atoms: | 13 |
| TPSA: | 84.22 | NumAromaticRings: | 1 |
