| Properties | Image | Occurences in reactions |
MNX_ID | MNXM101863 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C20H22F3NO6 |
charge | 0 |
mass | 429.13992 |
reference | chebi:68315 |
InChIKey | HERFZNMLZYGZDD-CHPYXAQWSA-N |
InChI | InChI=1S/C18H21NO4.C2HF3O2/c1-11(20)23-13-3-4-18-5-6-19(17(18)8-13)10-12-7-15(21)16(22-2)9-14(12)18;3-2(4,5)1(6)7/h3-4,7,9,13,17,21H,5-6,8,10H2,1-2H3;(H,6,7)/t13-,17+,18+;/m1./s1 |
SMILES | COc1cc2c(cc1O)CN1CC[C@@]23C=C[C@@H](OC(C)=O)C[C@H]13.O=C(O)C(F)(F)F |
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