Viewing Compound With Structures

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Compound Report Overview

Compound Name: J-104132
Compound Identifier: 704203
Mol Structure 2D: 704203
Molecular Weight: 532
Formula: C31 H33 N O7
Development Status: Clinical, Phase II/III
SMILES: CCCCc1ccc2C(C(C(c2n1)c3ccc(OC)cc3CC(C)C(=O)O)C(=O)O)c4ccc5OCOc5c4
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100223282D 0 0.00000 0.00000 0^^ 39 43 0 1 0 999 V2000^ -0.7000 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.0375 -0.8625 0.0000 C 0 0 1 0 0 0 0 0 0^ -0.7000 -0.6292 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.0375 0.3833 0.0000 C 0 0 2 0 0 0 0 0 0^ 0.5000 -0.2125 0.0000 C 0 0 2 0 0 0 0 0 0^ 0.0375 1.1750 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.0375 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.7000 1.5750 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.3833 0.5500 0.0000 N 0 0 0 0 0 0 0 0 0^ 1.2625 -0.2125 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.7167 -2.0375 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.7167 -2.8167 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.7125 1.1750 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.3792 1.1750 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.3833 -1.0250 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.6375 1.5750 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.0375 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.3167 -3.3000 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.0500 1.5625 0.0000 C 0 0 2 0 0 0 0 0 0^ 0.2167 -3.9875 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.7000 2.3458 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.6208 -2.0375 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.0000 -4.0417 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.6292 0.4833 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.7125 0.3875 0.0000 O 0 0 0 0 0 0 0 0 0^ -0.6208 -2.8167 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.0500 0.1375 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.0375 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.0500 -0.6292 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.6917 -0.8792 0.0000 O 0 0 0 0 0 0 0 0 0^ -0.6375 2.3458 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.3792 1.5625 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.0375 3.5458 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.0500 2.3458 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.7458 0.5375 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.7375 3.8833 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.4208 0.1375 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.1083 0.5375 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.7833 0.1375 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 3 1 0 0 0^ 3 1 2 0 0 0^ 4 1 1 0 0 0^ 5 4 1 0 0 0^ 4 6 1 1 0 0^ 2 7 1 1 0 0^ 8 6 1 0 0 0^ 9 1 1 0 0 0^ 5 10 1 6 0 0^ 11 7 1 0 0 0^ 12 11 2 0 0 0^ 13 19 1 0 0 0^ 14 8 1 0 0 0^ 15 3 1 0 0 0^ 16 6 2 0 0 0^ 17 26 2 0 0 0^ 18 12 1 0 0 0^ 19 14 1 0 0 0^ 20 17 1 0 0 0^ 21 8 2 0 0 0^ 22 7 2 0 0 0^ 23 18 1 0 0 0^ 24 10 2 0 0 0^ 25 13 2 0 0 0^ 26 22 1 0 0 0^ 27 9 2 0 0 0^ 28 31 2 0 0 0^ 29 27 1 0 0 0^ 30 10 1 0 0 0^ 31 16 1 0 0 0^ 32 13 1 0 0 0^ 33 28 1 0 0 0^ 19 34 1 6 0 0^ 35 27 1 0 0 0^ 36 33 1 0 0 0^ 37 35 1 0 0 0^ 38 37 1 0 0 0^ 39 38 1 0 0 0^ 2 5 1 0 0 0^ 29 15 2 0 0 0^ 28 21 1 0 0 0^ 17 12 1 0 0 0^ 23 20 1 0 0 0^M END^^
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