| Properties | Image | Occurences in reactions |
MNX_ID | MNXM101994 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C18H20F3NO6 |
charge | 0 |
mass | 403.12427 |
reference | chebi:68303 |
InChIKey | KMXPVDCNAVLQCI-SNCSXGFESA-N |
InChI | InChI=1S/C16H19NO4.C2HF3O2/c18-11-1-2-14-16(15(11)19)3-4-17(14)7-9-5-12-13(6-10(9)16)21-8-20-12;3-2(4,5)1(6)7/h5-6,11,14-15,18-19H,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@H]2N3CC[C@@]2(c2cc4c(cc2C3)OCO4)[C@H]1O |
|