Viewing Compound With Structures

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Gene Compound Experiment Study Pathway Assay Report Bug Request Feature

Compound Report Overview

Compound Name: STERCURONIUM IODIDE
Compound Identifier: 705158
Mol Structure 2D: 705158
Molecular Weight: 511
Formula: C26 H43 N2 . I
Development Status: Preclinical
SMILES: [I-].CC[N+](C)(C)C1CCC2(C)C3CCC45CN(C)C(C)C5CCC4C3C=CC2=C1
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222412D 0 0.00000 0.00000 0^^ 29 32 0 0 0 999 V2000^ 1.9125 0.6750 0.0000 C 0 0 3 0 0 0 0 0 0^ -0.5000 -0.7000 0.0000 C 0 0 3 0 0 0 0 0 0^ -0.5000 -1.6125 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.8167 2.0208 0.0000 N 0 0 3 0 0 0 0 0 0^ 1.9125 -0.2375 0.0000 C 0 0 3 0 0 0 0 0 0^ 3.1542 0.6875 0.0000 C 0 0 3 0 0 0 0 0 0^ 1.1042 -0.7000 0.0000 C 0 0 3 0 0 0 0 0 0^ 0.3000 -0.2375 0.0000 C 0 0 3 0 0 0 0 0 0^ 1.9250 1.7208 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.1042 -1.6125 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.3083 -2.0667 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.5375 1.4500 0.0000 C 0 0 3 0 0 0 0 0 0^ 0.3000 -2.0667 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.1042 1.1333 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.1083 -1.6125 0.0000 C 0 0 3 0 0 0 0 0 0^ -2.9333 -2.0792 0.0000 N 0 3 3 0 0 0 0 0 0^ 0.3000 0.6750 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.3083 -0.2375 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.6875 -0.7125 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.4375 -0.2000 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.1083 -0.7000 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.8792 2.9083 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.5000 0.3458 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.4000 -1.2667 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.9708 -2.6125 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.4583 -2.9042 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.3417 1.6333 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.3458 -1.2667 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.1958 -0.1167 0.0000 I 0 5 0 0 0 0 0 0 0^ 2 8 1 0 0 0^ 3 2 1 0 0 0^ 4 9 1 0 0 0^ 5 1 1 0 0 0^ 6 1 1 0 0 0^ 7 5 1 0 0 0^ 8 17 1 0 0 0^ 9 1 1 0 0 0^ 10 7 1 0 0 0^ 11 3 2 0 0 0^ 12 6 1 0 0 0^ 13 10 2 0 0 0^ 14 1 1 0 0 0^ 15 21 1 0 0 0^ 16 15 1 0 0 0^ 17 14 1 0 0 0^ 18 2 1 0 0 0^ 19 5 1 0 0 0^ 20 6 1 0 0 0^ 21 18 1 0 0 0^ 22 4 1 0 0 0^ 23 2 1 0 0 0^ 24 16 1 0 0 0^ 25 16 1 0 0 0^ 26 16 1 0 0 0^ 27 12 1 0 0 0^ 28 24 1 0 0 0^ 20 19 1 0 0 0^ 4 12 1 0 0 0^ 8 7 1 0 0 0^ 3 13 1 0 0 0^ 15 11 1 0 0 0^M CHG 2 16 1 29 -1^M END^^
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