Viewing Compound With Structures

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Gene Compound Experiment Study Pathway Assay Report Bug Request Feature

Compound Report Overview

Compound Name: PHETHARBITAL
Compound Identifier: 704849
Mol Structure 2D: 704849
Molecular Weight: 260
Formula: C14 H16 N2 O3
Development Status: Preclinical
SMILES: CCC1(CC)C(=O)NC(=O)N(C1=O)c2ccccc2
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222302D 0 0.00000 0.00000 0^^ 19 20 0 0 0 999 V2000^ -0.5333 -0.1417 0.0000 N 0 0 3 0 0 0 0 0 0^ -0.5333 -1.6125 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6917 0.5458 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6917 -2.3375 0.0000 N 0 0 0 0 0 0 0 0 0^ 1.9292 -0.1417 0.0000 C 0 0 3 0 0 0 0 0 0^ 1.9292 -1.6125 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.7833 0.5458 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.7833 -2.3375 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.6917 1.9833 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.1875 -2.3375 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.3542 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.8375 0.9333 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.7833 1.9833 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.0208 -0.1417 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.8375 -1.7417 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.2542 0.6958 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.2583 0.5458 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.0208 2.6875 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.2583 1.9833 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 1 1 0 0 0^ 4 2 1 0 0 0^ 5 3 1 0 0 0^ 6 5 1 0 0 0^ 7 1 1 0 0 0^ 8 2 2 0 0 0^ 9 3 2 0 0 0^ 10 6 2 0 0 0^ 11 5 1 0 0 0^ 12 5 1 0 0 0^ 13 7 2 0 0 0^ 14 7 1 0 0 0^ 15 11 1 0 0 0^ 16 12 1 0 0 0^ 17 14 2 0 0 0^ 18 13 1 0 0 0^ 19 17 1 0 0 0^ 6 4 1 0 0 0^ 19 18 2 0 0 0^M END^^
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