Glycoside
GD081964
Name:
NoneFormula:
C16H26O9N2SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@@H]2N3C(=O)C[C@H]3S(=O)(=O)C2(C)C)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC1(C)C(C(=O)NCCO)N2C(=O)CC2S1(=O)=OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.88 |
| AlogP: | -2.92 | Num_rotatable_bonds: | 5 |
| MolWt: | 422.46 | Num_heavy_atoms: | 28 |
| TPSA: | 162.7 | NumAromaticRings: | 0 |
Unique Aglycone
AD36808
Formula: C10H16O5N2S
Smiles:
CC1(C)C(C(=O)NCCO)N2C(=O)CC2S1(=O)=O| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 3 |
| MolWt: | 276.31 | Num_heavy_atoms: | 18 |
| TPSA: | 103.78 | NumAromaticRings: | 0 |
