Glycoside
GD005380
Name:
NoneFormula:
C25H37O6N3Cl2Smiles:
CO[C@@H]1[C@H](OC(N)=O)[C@H](O)C(N(CCCc2ccc(N(CCCl)CCCl)cc2)OC)OC1(C)CAglycone:
CONCCCc1ccc(N(CCCl)CCCl)cc1Sugarmoiety:
COC1C(OC(N)=O)C(O)C(O)OC1(C)COther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.7 |
| AlogP: | 2.74 | Num_rotatable_bonds: | 13 |
| MolWt: | 522.47 | Num_heavy_atoms: | 34 |
| TPSA: | 106.72 | NumAromaticRings: | 1 |
Unique Aglycone
AD03643
Formula: C16H22ON2Cl2
Smiles:
CONCCCc1ccc(N(CCCl)CCCl)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.57 |
| AlogP: | 3.05 | Num_rotatable_bonds: | 10 |
| MolWt: | 305.25 | Num_heavy_atoms: | 19 |
| TPSA: | 24.5 | NumAromaticRings: | 1 |
