Glycoside
GD020395
Name:
NoneFormula:
C23H28O8N7ClSmiles:
NC(=NC(=O)c1nc(Cl)c(N)nc1N)NCCCCc1ccc(OC2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
NC(=NC(=O)c1nc(Cl)c(N)nc1N)NCCCCc1ccc(O)cc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 11 | FractionCSP3: | 0.41 |
| AlogP: | -1.37 | Num_rotatable_bonds: | 9 |
| MolWt: | 553.96 | Num_heavy_atoms: | 38 |
| TPSA: | 261.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD14086
Formula: C17H20O2N7Cl
Smiles:
NC(=NC(=O)c1nc(Cl)c(N)nc1N)NCCCCc1ccc(O)cc1| HBA: | 9 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.25 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 6 |
| MolWt: | 377.84 | Num_heavy_atoms: | 26 |
| TPSA: | 165.53 | NumAromaticRings: | 2 |
