Viewing Compound With Structures

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Gene Compound Experiment Study Pathway Assay Report Bug Request Feature

Compound Report Overview

Compound Name: MIRISETRON
Compound Identifier: 703427
Mol Structure 2D: 703427
Molecular Weight: 394
Formula: C24 H31 N3 O2
Development Status: Clinical, Phase I
SMILES: CN1C2CCC1CC(C2)NC(=O)c3cn(C4CCCCC4)c5ccccc5c3=O
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100223162D 0 0.00000 0.00000 0^^ 29 33 0 0 0 999 V2000^ 6.2667 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0^ 6.8667 1.3208 0.0000 O 0 0 0 0 0 0 0 0 0^ 7.5248 0.2476 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.1682 -0.8538 0.0000 N 0 0 3 0 0 0 0 0 0^ 7.5250 -0.4930 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.1633 0.6108 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.8779 0.6104 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.7920 0.2582 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.8035 -0.4792 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.1538 1.3519 0.0000 O 0 0 0 0 0 0 0 0 0^ 8.1628 -1.5960 0.0000 C 0 0 3 0 0 0 0 0 0^ 9.4325 0.6251 0.0000 C 0 0 0 0 0 0 0 0 0^ 9.4427 -0.8473 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.5295 -1.9670 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.8133 -1.9609 0.0000 C 0 0 0 0 0 0 0 0 0^ 10.0825 0.2509 0.0000 C 0 0 0 0 0 0 0 0 0^ 10.0930 -0.4715 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.5431 -2.7008 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.8196 -2.6906 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.1766 -3.0704 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.3855 1.6372 0.0000 C 0 0 3 0 0 0 0 0 0^ 6.1645 1.6439 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.9165 2.0117 0.0000 N 0 0 3 0 0 0 0 0 0^ 6.2733 0.9546 0.0000 C 0 0 1 0 0 0 0 0 0^ 5.0316 1.3278 0.0000 C 0 0 1 0 0 0 0 0 0^ 5.8448 1.3196 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.1103 1.0417 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.5871 0.7306 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.5734 2.6059 0.0000 C 0 0 0 0 0 0 0 0 0^ 12 8 1 0 0 0^ 13 9 1 0 0 0^ 14 11 1 0 0 0^ 15 11 1 0 0 0^ 16 12 2 0 0 0^ 17 16 1 0 0 0^ 18 14 1 0 0 0^ 19 15 1 0 0 0^ 20 19 1 0 0 0^ 4 9 1 0 0 0^ 13 17 2 0 0 0^ 18 20 1 0 0 0^ 7 2 2 0 0 0^ 7 1 1 0 0 0^ 4 5 1 0 0 0^ 5 3 2 0 0 0^ 6 3 1 0 0 0^ 7 3 1 0 0 0^ 8 6 1 0 0 0^ 9 8 2 0 0 0^ 10 6 2 0 0 0^ 11 4 1 0 0 0^ 27 21 1 0 0 0^ 28 27 1 0 0 0^ 29 23 1 0 0 0^ 28 25 1 0 0 0^ 25 26 1 1 0 0^ 22 21 1 0 0 0^ 23 21 1 0 0 0^ 24 22 1 0 0 0^ 25 23 1 0 0 0^ 26 24 1 0 0 0^ 24 1 1 6 0 0^M END^^
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