Glycoside
GD000713
Name:
NoneFormula:
C34H35O5N6F3SSmiles:
O=C(NCCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O)c1ccc(-c2sccc2-c2cccc(C(F)(F)F)c2)cc1Aglycone:
O=C(NCCCCCCNc1ncnc2c1N=C[N]2)c1ccc(-c2sccc2-c2cccc(C(F)(F)F)c2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 5.25 | Num_rotatable_bonds: | 13 |
| MolWt: | 696.75 | Num_heavy_atoms: | 49 |
| TPSA: | 154.65 | NumAromaticRings: | 5 |
Unique Aglycone
AD00763
Formula: C29H26ON6F3S
Smiles:
O=C(NCCCCCCNc1ncnc2c1N=C[N]2)c1ccc(-c2sccc2-c2cccc(C(F)(F)F)c2)cc1| HBA: | 7 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.24 |
| AlogP: | 7.2 | Num_rotatable_bonds: | 11 |
| MolWt: | 563.63 | Num_heavy_atoms: | 40 |
| TPSA: | 93.37 | NumAromaticRings: | 4 |
