Glycoside
GD101936
Name:
NoneFormula:
C19H23O6N3S2Smiles:
Cc1ccnc(SCC(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3O)cc2)n1Aglycone:
Cc1ccnc(SCC(=O)Nc2ccc(S)cc2)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | 0.41 | Num_rotatable_bonds: | 7 |
| MolWt: | 453.54 | Num_heavy_atoms: | 30 |
| TPSA: | 145.03 | NumAromaticRings: | 2 |
Unique Aglycone
AD43154
Formula: C13H13ON3S2
Smiles:
Cc1ccnc(SCC(=O)Nc2ccc(S)cc2)n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.15 |
| AlogP: | 2.8 | Num_rotatable_bonds: | 4 |
| MolWt: | 291.4 | Num_heavy_atoms: | 19 |
| TPSA: | 54.88 | NumAromaticRings: | 2 |
