Viewing Compound With Structures

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Compound Report Overview

Compound Name: ICX5600138
Compound Identifier: 602179
Mol Structure 2D: 602179
Molecular Weight: 380
Formula: C16 H24 N6 O5
Development Status: Laboratory Testing
SMILES: COC(=O)C(CCCNC(=N)N[N+](=O)[O-])NC(=O)C(N)Cc1ccccc1
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100221582D 0 0.00000 0.00000 0^^ 27 27 0 0 0 999 V2000^ 7.4833 -5.7500 0.0000 N 0 3 0 0 0 0 0 0 0^ 7.4833 -4.9208 0.0000 N 0 0 0 0 0 0 0 0 0^ 4.6083 -2.4333 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.7667 -4.5083 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.3292 -2.0167 0.0000 N 0 0 0 0 0 0 0 0 0^ 6.7667 -2.0208 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.2000 -6.1667 0.0000 O 0 5 0 0 0 0 0 0 0^ 6.0458 -2.4333 0.0000 C 0 0 2 0 0 0 0 0 0^ 3.8958 -2.0208 0.0000 C 0 0 2 0 0 0 0 0 0^ 6.7667 -6.1667 0.0000 O 0 0 0 0 0 0 0 0 0^ 6.7625 -3.6792 0.0000 N 0 0 0 0 0 0 0 0 0^ 4.6083 -3.2625 0.0000 O 0 0 0 0 0 0 0 0 0^ 6.7667 -1.1917 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.8958 -1.1917 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.0500 -4.9208 0.0000 N 0 0 0 0 0 0 0 0 0^ 3.1792 -2.4333 0.0000 N 0 0 0 0 0 0 0 0 0^ 7.4792 -2.4292 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.1792 -0.7750 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.0458 -3.2625 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.3292 -4.5083 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.2042 -2.0208 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.1833 0.0542 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.4625 -1.1917 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.3250 -3.6750 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.7458 -0.7750 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.4625 0.4667 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.7458 0.0542 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 5 1 0 0 0^ 4 2 1 0 0 0^ 5 8 1 0 0 0^ 6 8 1 0 0 0^ 7 1 1 0 0 0^ 8 19 1 6 0 0^ 9 3 1 0 0 0^ 10 1 2 0 0 0^ 11 4 2 0 0 0^ 12 3 2 0 0 0^ 13 6 2 0 0 0^ 9 14 1 1 0 0^ 15 4 1 0 0 0^ 16 9 1 0 0 0^ 17 6 1 0 0 0^ 18 14 1 0 0 0^ 19 24 1 0 0 0^ 20 15 1 0 0 0^ 21 17 1 0 0 0^ 22 18 2 0 0 0^ 23 18 1 0 0 0^ 24 20 1 0 0 0^ 25 23 2 0 0 0^ 26 22 1 0 0 0^ 27 25 1 0 0 0^ 27 26 2 0 0 0^M CHG 2 1 1 7 -1^M END^^
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