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Compound Report Overview

Compound Name: ICX5608939

Compound Identifier: 707900

Mol Structure 2D: 707900

Molecular Weight: 305

Formula: C13 H11 N3 O6

Development Status: Laboratory Testing

SMILES: OC(=O)Cn1c(=O)ccn(Cc2cccc(c2)[N+](=O)[O-])c1=O

Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets

Compound Structures

>^ ISISHOST06100221392D 0 0.00000 0.00000 0^^ 22 23 0 0 0 999 V2000^ 6.8250 -6.2792 0.0000 N 0 0 3 0 0 0 0 0 0^ 6.1125 -6.6917 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.4000 -6.2792 0.0000 N 0 0 3 0 0 0 0 0 0^ 6.8250 -5.4542 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.2625 -4.2250 0.0000 N 0 3 0 0 0 0 0 0 0^ 6.1042 -5.0417 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.3917 -5.4625 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.5375 -6.6917 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.2542 -5.0500 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.6875 -6.6917 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.1042 -7.5167 0.0000 O 0 0 0 0 0 0 0 0 0^ 8.2500 -6.2792 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.5417 -3.8042 0.0000 O 0 5 0 0 0 0 0 0 0^ 3.9750 -3.8125 0.0000 O 0 0 0 0 0 0 0 0 0^ 7.5417 -5.0500 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.9667 -5.4625 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.9667 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.2500 -5.4542 0.0000 O 0 0 0 0 0 0 0 0 0^ 8.9667 -6.6917 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.5417 -5.4625 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.5417 -6.2875 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.2542 -6.7000 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 2 1 0 0 0^ 4 1 1 0 0 0^ 5 9 1 0 0 0^ 6 4 1 0 0 0^ 7 6 2 0 0 0^ 8 1 1 0 0 0^ 9 16 2 0 0 0^ 10 3 1 0 0 0^ 11 2 2 0 0 0^ 12 8 1 0 0 0^ 13 5 1 0 0 0^ 14 5 2 0 0 0^ 15 4 2 0 0 0^ 16 17 1 0 0 0^ 17 10 1 0 0 0^ 18 12 2 0 0 0^ 19 12 1 0 0 0^ 20 21 2 0 0 0^ 21 22 1 0 0 0^ 22 17 2 0 0 0^ 7 3 1 0 0 0^ 9 20 1 0 0 0^M CHG 2 5 1 13 -1^M END^^

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