Glycoside
GD061820
Name:
NoneFormula:
C13H17O4N5SSmiles:
C=C(C)Nc1[nH]c(=S)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
C=C(C)Nc1[nH]c(=S)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | 0.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 339.38 | Num_heavy_atoms: | 23 |
| TPSA: | 128.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD30234
Formula: C8H8N5S
Smiles:
C=C(C)Nc1[nH]c(=S)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 2 |
| MolWt: | 206.25 | Num_heavy_atoms: | 14 |
| TPSA: | 67.17 | NumAromaticRings: | 1 |
