| Properties | Image | Occurences in reactions |
MNX_ID | MNXM104087 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C18H20F3NO7 |
charge | 0 |
mass | 419.11919 |
reference | chebi:68313 |
InChIKey | UBPSZAPZJVBEAU-CHIYLFTISA-N |
InChI | InChI=1S/C16H19NO5.C2HF3O2/c18-11-1-2-16(20)15(14(11)19)3-4-17(16)7-9-5-12-13(6-10(9)15)22-8-21-12;3-2(4,5)1(6)7/h5-6,11,14,18-20H,1-4,7-8H2;(H,6,7)/t11-,14-,15+,16-;/m0./s1 |
SMILES | O=C(O)C(F)(F)F.O[C@H]1CC[C@@]2(O)N3CC[C@@]2(c2cc4c(cc2C3)OCO4)[C@H]1O |
|