Viewing Compound With Structures

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Gene Compound Experiment Study Pathway Assay Report Bug Request Feature

Compound Report Overview

Compound Name: FLUCRYLATE
Compound Identifier: 701737
Mol Structure 2D: 701737
Molecular Weight: 193
Formula: C7 H6 F3 N O2
Development Status: Preclinical
SMILES: CC(OC(=O)C(=C)C#N)C(F)(F)F
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222392D 0 0.00000 0.00000 0^^ 13 12 0 0 0 999 V2000^ 4.7000 -2.8667 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.1250 -2.1417 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.9375 -3.5750 0.0000 C 0 0 3 0 0 0 0 0 0^ 5.9375 -2.1625 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.8875 -2.8667 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.0500 -2.8667 0.0000 N 0 0 0 0 0 0 0 0 0^ 6.3625 -2.8542 0.0000 C 0 0 3 0 0 0 0 0 0^ 4.7000 -1.4292 0.0000 O 0 0 0 0 0 0 0 0 0^ 5.1250 -3.5542 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.0792 -3.9667 0.0000 F 0 0 0 0 0 0 0 0 0^ 5.2375 -4.3125 0.0000 F 0 0 0 0 0 0 0 0 0^ 6.2292 -4.4667 0.0000 F 0 0 0 0 0 0 0 0 0^ 7.1792 -2.8542 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 7 1 0 0 0^ 4 2 1 0 0 0^ 5 1 1 0 0 0^ 6 5 3 0 0 0^ 7 4 1 0 0 0^ 8 2 2 0 0 0^ 9 1 2 0 0 0^ 10 3 1 0 0 0^ 11 3 1 0 0 0^ 12 3 1 0 0 0^ 13 7 1 0 0 0^M END^^
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