Glycoside
GD064670
Name:
NoneFormula:
C12H15O6N5SSmiles:
COC(=O)Nc1[nH]c(=S)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
COC(=O)Nc1[nH]c(=S)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.72 | Num_rotatable_bonds: | 3 |
| MolWt: | 357.35 | Num_heavy_atoms: | 24 |
| TPSA: | 154.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD31122
Formula: C7H6O2N5S
Smiles:
COC(=O)Nc1[nH]c(=S)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.23 | Num_rotatable_bonds: | 1 |
| MolWt: | 224.22 | Num_heavy_atoms: | 15 |
| TPSA: | 93.47 | NumAromaticRings: | 1 |
