Glycoside
GD060272
Name:
NoneFormula:
C14H18O5N2SSmiles:
Cc1nc2c(N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)cccc2s1Aglycone:
Cc1nc2c(N)cccc2s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 326.37 | Num_heavy_atoms: | 22 |
| TPSA: | 115.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD29790
Formula: C8H8N2S
Smiles:
Cc1nc2c(N)cccc2s1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 2.19 | Num_rotatable_bonds: | 0 |
| MolWt: | 164.23 | Num_heavy_atoms: | 11 |
| TPSA: | 38.91 | NumAromaticRings: | 2 |
