Glycoside
GD012608
Name:
NoneFormula:
C17H23O6N5SSmiles:
CCOc1ncn(-c2ccc(NC(=S)NC3OC(CO)C(O)C(O)C3O)cc2)n1Aglycone:
CCOc1ncn(-c2ccc(NC(N)=S)cc2)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.47 |
| AlogP: | -1.25 | Num_rotatable_bonds: | 6 |
| MolWt: | 425.47 | Num_heavy_atoms: | 29 |
| TPSA: | 154.15 | NumAromaticRings: | 2 |
Unique Aglycone
AD09492
Formula: C11H13ON5S
Smiles:
CCOc1ncn(-c2ccc(NC(N)=S)cc2)n1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.18 |
| AlogP: | 1.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 263.33 | Num_heavy_atoms: | 18 |
| TPSA: | 77.99 | NumAromaticRings: | 2 |
