Glycoside
GD084871
Name:
NoneFormula:
C16H23O6N5SSmiles:
COC(=O)CCSCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
COC(=O)CCSCCNc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -0.85 | Num_rotatable_bonds: | 9 |
| MolWt: | 413.46 | Num_heavy_atoms: | 28 |
| TPSA: | 151.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD37977
Formula: C11H14O2N5S
Smiles:
COC(=O)CCSCCNc1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.45 |
| AlogP: | 1.09 | Num_rotatable_bonds: | 7 |
| MolWt: | 280.33 | Num_heavy_atoms: | 19 |
| TPSA: | 90.57 | NumAromaticRings: | 1 |
