Glycoside
GD007534
Name:
NoneFormula:
C20H32O7N5SSmiles:
O=S(=O)([O-])CCCCCCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
O=S(=O)([O-])CCCCCCCCCCNc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.75 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 14 |
| MolWt: | 486.57 | Num_heavy_atoms: | 33 |
| TPSA: | 182.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD06121
Formula: C15H23O3N5S
Smiles:
O=S(=O)([O-])CCCCCCCCCCNc1ncnc2c1N=C[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 12 |
| MolWt: | 353.45 | Num_heavy_atoms: | 24 |
| TPSA: | 121.47 | NumAromaticRings: | 1 |
