Glycoside
GD053609
Name:
NoneFormula:
C14H23O6N2SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@@H]([NH3+])c2ccsc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
[NH3+]C(C(=O)NCCO)c1ccsc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.64 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 6 |
| MolWt: | 347.41 | Num_heavy_atoms: | 23 |
| TPSA: | 135.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD27351
Formula: C8H13O2N2S
Smiles:
[NH3+]C(C(=O)NCCO)c1ccsc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.86 | Num_rotatable_bonds: | 4 |
| MolWt: | 201.27 | Num_heavy_atoms: | 13 |
| TPSA: | 76.97 | NumAromaticRings: | 1 |
