Glycoside
GD015346
Name:
NoneFormula:
C18H29O4N5SSmiles:
CCCCCCNc1nc(SCC)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CCCCCCNc1nc(SCC)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.72 |
| AlogP: | 1.54 | Num_rotatable_bonds: | 10 |
| MolWt: | 411.53 | Num_heavy_atoms: | 28 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD11162
Formula: C13H20N5S
Smiles:
CCCCCCNc1nc(SCC)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.62 |
| AlogP: | 3.49 | Num_rotatable_bonds: | 8 |
| MolWt: | 278.4 | Num_heavy_atoms: | 19 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
