Glycoside
GD053334
Name:
NoneFormula:
C11H15O5N5SSmiles:
CSc1nc2c(=O)[nH]c(N)nc2n1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CSC1=Nc2c(nc(N)[nH]c2=O)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.55 |
| AlogP: | -1.96 | Num_rotatable_bonds: | 3 |
| MolWt: | 329.34 | Num_heavy_atoms: | 22 |
| TPSA: | 159.51 | NumAromaticRings: | 2 |
Unique Aglycone
AD27249
Formula: C6H6ON5S
Smiles:
CSC1=Nc2c(nc(N)[nH]c2=O)[N]1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 0 |
| MolWt: | 196.22 | Num_heavy_atoms: | 13 |
| TPSA: | 98.23 | NumAromaticRings: | 1 |
