Glycoside
GD068601
Name:
NoneFormula:
C14H16O5N3ClSSmiles:
Cc1csc2c(N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)nc(Cl)nc12Aglycone:
Cc1csc2c(N)nc(Cl)nc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -0.14 | Num_rotatable_bonds: | 3 |
| MolWt: | 361.81 | Num_heavy_atoms: | 23 |
| TPSA: | 127.96 | NumAromaticRings: | 2 |
Unique Aglycone
AD32507
Formula: C8H6N3ClS
Smiles:
Cc1csc2c(N)nc(Cl)nc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 2.24 | Num_rotatable_bonds: | 0 |
| MolWt: | 199.67 | Num_heavy_atoms: | 12 |
| TPSA: | 51.8 | NumAromaticRings: | 2 |
