Viewing Compound With Structures

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Gene Compound Experiment Study Pathway Assay Report Bug Request Feature

Compound Report Overview

Compound Name: FENESTREL
Compound Identifier: 705023
Mol Structure 2D: 705023
Molecular Weight: 244
Formula: C16 H20 O2
Development Status: Preclinical
SMILES: CCC1C(C)C(CC=C1c2ccccc2)C(=O)O
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222372D 0 0.00000 0.00000 0^^ 18 19 0 0 0 999 V2000^ -0.4208 -0.9542 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.2292 0.1708 0.0000 C 0 0 3 0 0 0 0 0 0^ 0.2292 -2.0875 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.5375 0.1708 0.0000 C 0 0 3 0 0 0 0 0 0^ 2.1917 -0.9542 0.0000 C 0 0 3 0 0 0 0 0 0^ 3.5000 -0.9542 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.5375 -2.0875 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.7208 -0.9542 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.2000 0.1875 0.0000 O 0 0 0 0 0 0 0 0 0^ 4.0167 -2.1042 0.0000 O 0 0 0 0 0 0 0 0 0^ -0.4208 1.3000 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.1792 1.3000 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.3708 0.1708 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.3708 -2.0875 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.2167 2.4250 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.6833 -2.0875 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.6833 0.1708 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.3458 -0.9542 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 1 2 0 0 0^ 4 2 1 0 0 0^ 5 7 1 0 0 0^ 6 5 1 0 0 0^ 7 3 1 0 0 0^ 8 1 1 0 0 0^ 9 6 2 0 0 0^ 10 6 1 0 0 0^ 11 2 1 0 0 0^ 12 4 1 0 0 0^ 13 8 2 0 0 0^ 14 8 1 0 0 0^ 15 11 1 0 0 0^ 16 14 2 0 0 0^ 17 13 1 0 0 0^ 18 16 1 0 0 0^ 5 4 1 0 0 0^ 18 17 2 0 0 0^M END^^
Structure View
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