| Properties | Image | Occurences in reactions |
MNX_ID | MNXM150626 |
|
| #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
formula | C21H24F3NO8 |
charge | 0 |
mass | 475.1454 |
reference | chebi:68316 |
InChIKey | ZYTSUMQIOKJQNI-QCAFIXIBSA-N |
InChI | InChI=1S/C19H23NO6.C2HF3O2/c1-10(21)26-13-3-4-15-19(18(13)22)5-6-20(15)8-11-12(19)7-14-17(16(11)23-2)25-9-24-14;3-2(4,5)1(6)7/h7,13,15,18,22H,3-6,8-9H2,1-2H3;(H,6,7)/t13-,15+,18-,19-;/m0./s1 |
SMILES | COc1c2c(cc3c1OCO3)[C@@]13CCN(C2)[C@@H]1CC[C@H](OC(C)=O)[C@@H]3O.O=C(O)C(F)(F)F |
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