Glycoside
GD102898
Name:
NoneFormula:
C22H23O7N3SSmiles:
Cn1c(=O)c(C(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3O)cc2)nc2ccccc21Aglycone:
Cn1c(=O)c(C(=O)Nc2ccc(S)cc2)nc2ccccc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 5 |
| MolWt: | 473.51 | Num_heavy_atoms: | 33 |
| TPSA: | 154.14 | NumAromaticRings: | 3 |
Unique Aglycone
AD43558
Formula: C16H13O2N3S
Smiles:
Cn1c(=O)c(C(=O)Nc2ccc(S)cc2)nc2ccccc21| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.06 |
| AlogP: | 2.47 | Num_rotatable_bonds: | 2 |
| MolWt: | 311.37 | Num_heavy_atoms: | 22 |
| TPSA: | 63.99 | NumAromaticRings: | 3 |
