Glycoside
GD015515
Name:
NoneFormula:
C12H17O4N5SSmiles:
CSc1nc(N)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@]1(C)OAglycone:
CSc1nc(N)nc2c1N=C[N]2Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 3 |
| MolWt: | 327.37 | Num_heavy_atoms: | 22 |
| TPSA: | 139.54 | NumAromaticRings: | 2 |
Unique Aglycone
AD11262
Formula: C6H6N5S
Smiles:
CSc1nc(N)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 1 |
| MolWt: | 180.22 | Num_heavy_atoms: | 12 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
