Glycoside
GD068966
Name:
NoneFormula:
C14H19O6N2F3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cc(C(F)(F)F)c[nH]2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1cc(C(F)(F)F)c[nH]1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -0.39 | Num_rotatable_bonds: | 5 |
| MolWt: | 368.31 | Num_heavy_atoms: | 25 |
| TPSA: | 124.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD32675
Formula: C8H9O2N2F3
Smiles:
O=C(NCCO)c1cc(C(F)(F)F)c[nH]1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.38 |
| AlogP: | 0.76 | Num_rotatable_bonds: | 3 |
| MolWt: | 222.17 | Num_heavy_atoms: | 15 |
| TPSA: | 65.12 | NumAromaticRings: | 1 |
