Viewing Compound With Structures

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Gene Compound Experiment Study Pathway Assay Report Bug Request Feature

Compound Report Overview

Compound Name: TIMEFURONE
Compound Identifier: 705390
Mol Structure 2D: 705390
Molecular Weight: 306
Formula: C15 H14 O5 S
Development Status: Preclinical
SMILES: COc1c2ccoc2c(OC)c3oc(CSC)cc(=O)c13
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222482D 0 0.00000 0.00000 0^^ 21 23 0 0 0 999 V2000^ -0.6250 0.5833 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.6250 -0.5750 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.6125 1.1708 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.6000 0.6083 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.3542 1.1708 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.6125 -1.1292 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.6000 -0.5750 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.3792 0.6083 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.3542 -1.1292 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.3792 -0.5750 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.6875 -0.9375 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.6875 0.9458 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.3458 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.3542 2.3208 0.0000 O 0 0 0 0 0 0 0 0 0^ -1.6125 2.3208 0.0000 O 0 0 0 0 0 0 0 0 0^ -1.6125 -2.3167 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.3875 -0.6375 0.0000 S 0 0 0 0 0 0 0 0 0^ 2.3667 -1.1625 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.3417 -1.2292 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.6000 2.8833 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.6000 -2.8792 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 3 1 0 0 0^ 5 1 1 0 0 0^ 6 2 2 0 0 0^ 7 4 2 0 0 0^ 8 5 1 0 0 0^ 9 2 1 0 0 0^ 10 8 2 0 0 0^ 11 7 1 0 0 0^ 12 4 1 0 0 0^ 13 12 2 0 0 0^ 14 5 2 0 0 0^ 15 3 1 0 0 0^ 16 6 1 0 0 0^ 17 18 1 0 0 0^ 18 10 1 0 0 0^ 19 17 1 0 0 0^ 20 15 1 0 0 0^ 21 16 1 0 0 0^ 10 9 1 0 0 0^ 7 6 1 0 0 0^ 13 11 1 0 0 0^M END^^
Structure View
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