Glycoside
GD084179
Name:
NoneFormula:
C17H30O8N2SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@H]2SCCN2C(=O)OC(C)(C)C)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)N1CCSC1C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.88 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 5 |
| MolWt: | 422.5 | Num_heavy_atoms: | 28 |
| TPSA: | 137.79 | NumAromaticRings: | 0 |
Unique Aglycone
AD37571
Formula: C11H20O4N2S
Smiles:
CC(C)(C)OC(=O)N1CCSC1C(=O)NCCO| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.82 |
| AlogP: | 0.4 | Num_rotatable_bonds: | 3 |
| MolWt: | 276.36 | Num_heavy_atoms: | 18 |
| TPSA: | 78.87 | NumAromaticRings: | 0 |
