Viewing Compound With Structures

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Compound Report Overview

Compound Name: ICX5609048
Compound Identifier: 708008
Mol Structure 2D: 708008
Molecular Weight: 317
Formula: C18 H23 N O4
Development Status: Laboratory Testing
SMILES: CC12CCC3C(CCc4cc(O)c(cc34)[N+](=O)[O-])C2CCC1O
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100221402D 0 0.00000 0.00000 0^^ 25 28 0 0 0 999 V2000^ 2.1292 -4.9917 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.4125 -4.5750 0.0000 N 0 3 0 0 0 0 0 0 0^ 5.7042 -3.7667 0.0000 C 0 0 3 0 0 0 0 0 0^ 3.5542 -4.9917 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.6917 -4.5917 0.0000 C 0 0 2 0 0 0 0 0 0^ 4.2667 -4.5792 0.0000 C 0 0 3 0 0 0 0 0 0^ 4.9792 -4.9917 0.0000 C 0 0 3 0 0 0 0 0 0^ 2.8417 -4.5792 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.1292 -5.8167 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.5500 -5.8167 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.9917 -3.3500 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.2792 -3.7542 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.8417 -6.2292 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.9792 -5.8167 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.4750 -4.8500 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.4125 -3.7500 0.0000 O 0 5 0 0 0 0 0 0 0^ 0.7000 -4.9875 0.0000 O 0 0 0 0 0 0 0 0 0^ 6.4875 -3.5167 0.0000 C 0 0 2 0 0 0 0 0 0^ 4.2625 -6.2292 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.9625 -4.1917 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.4125 -6.2292 0.0000 O 0 0 0 0 0 0 0 0 0^ 5.7000 -2.9417 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.4792 -2.6917 0.0000 O 0 0 0 0 0 0 0 0 0^ 5.6917 -5.4167 0.0000 H 0 0 0 0 0 0 0 0 0^ 7.2792 -3.3042 0.0000 H 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 11 1 0 0 0^ 4 8 2 0 0 0^ 5 7 1 0 0 0^ 6 4 1 0 0 0^ 7 6 1 0 0 0^ 8 1 1 0 0 0^ 9 1 2 0 0 0^ 10 13 2 0 0 0^ 11 12 1 0 0 0^ 12 6 1 0 0 0^ 13 9 1 0 0 0^ 14 19 1 0 0 0^ 15 5 1 0 0 0^ 16 2 1 0 0 0^ 17 2 2 0 0 0^ 18 3 1 0 0 0^ 19 10 1 0 0 0^ 20 15 1 0 0 0^ 21 9 1 0 0 0^ 22 3 1 0 0 0^ 23 18 1 0 0 0^ 5 24 1 6 0 0^ 18 25 1 6 0 0^ 4 10 1 0 0 0^ 14 7 1 0 0 0^ 5 3 1 0 0 0^ 20 18 1 0 0 0^M CHG 2 2 1 16 -1^M END^^
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