Glycoside
GD090389
Name:
NoneFormula:
C18H26O8N2SSmiles:
CC(C)(C)OC(=O)N1Cc2ccsc2[C@H](NC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)C1Aglycone:
CC(C)(C)OC(=O)N1Cc2ccsc2C(N)C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -0.7 | Num_rotatable_bonds: | 6 |
| MolWt: | 430.48 | Num_heavy_atoms: | 29 |
| TPSA: | 156.63 | NumAromaticRings: | 1 |
Unique Aglycone
AD39336
Formula: C12H18O2N2S
Smiles:
CC(C)(C)OC(=O)N1Cc2ccsc2C(N)C1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.58 |
| AlogP: | 2.5 | Num_rotatable_bonds: | 0 |
| MolWt: | 254.35 | Num_heavy_atoms: | 17 |
| TPSA: | 55.56 | NumAromaticRings: | 1 |
