Concept information
Preferred term
7 [2 Trifluoromethyl 4 (2 hydroxyphenyl) 1,3 dioxan cis 5 yl] hept 5z enoiic acid
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C18H21F3O5
inchi
- InChI=1S/C18H21F3O5/c19-18(20,21)17-25-11-12(7-3-1-2-4-10-15(23)24)16(26-17)13-8-5-6-9-14(13)22/h1,3,5-6,8-9,12,16-17,22H,2,4,7,10-11H2,(H,23,24)/b3-1-/t12-,16+,17+/m1/s1
inchikey
- ZWAVGFSZMACJHA-PMNBYGLBSA-N
mass
- 374.356
monoisotopicmass
- 374.13411
smiles
- FC(F)(F)[C@@H]1O[C@@]([C@@H](CO1)C/C=C/CCCC(O)=O)(C=2C(O)=CC=CC2)[H]
subset
- 2_STAR
synonym EXACT
- (Z)-7-[(2S,4S,5R)-4-(2-hydroxyphenyl)-2-(triluoromethyl)-1,3-dioxan-5-yl]hept-5-enoic acid
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:168382
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