Glycoside
GD083513
Name:
NoneFormula:
C18H22O7NF3Smiles:
O=C(C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
FC(F)(F)Oc1ccc(C2CCNCC2)cc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 7 |
| MolWt: | 421.37 | Num_heavy_atoms: | 29 |
| TPSA: | 127.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD37269
Formula: C12H14ONF3
Smiles:
FC(F)(F)Oc1ccc(C2CCNCC2)cc1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 3.05 | Num_rotatable_bonds: | 2 |
| MolWt: | 245.24 | Num_heavy_atoms: | 17 |
| TPSA: | 21.26 | NumAromaticRings: | 1 |
