Viewing Compound With Structures

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Compound Report Overview

Compound Name: CASEANINE
Compound Identifier: 702695
Mol Structure 2D: 702695
Molecular Weight: 355
Formula: C21 H25 N O4
Development Status: Preclinical
SMILES: COc1ccc2CC3N(CCc4cc(OC)c(OC)cc34)Cc2c1OC
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222592D 0 0.00000 0.00000 0^^ 27 30 0 1 0 999 V2000^ 0.3875 -1.1542 0.0000 N 0 0 3 0 0 0 0 0 0^ -1.1875 -1.1542 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.3875 -0.2125 0.0000 C 0 0 2 0 0 0 0 0 0^ 1.1792 0.2458 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.3958 -1.6167 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.1875 -0.2125 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.3958 0.2458 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.9833 -1.6167 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.9792 -0.2125 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.1792 1.1625 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.9792 1.6208 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.7792 0.2458 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.7792 1.1625 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.1792 -1.6167 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.7833 -1.1542 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.9792 -1.1542 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.9833 0.2458 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.7833 -0.2125 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.9833 -2.5167 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.9792 2.5208 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.5625 1.6208 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.5500 -1.6167 0.0000 O 0 0 0 0 0 0 0 0 0^ -2.7583 -2.9667 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.7500 2.9833 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.3417 1.1625 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.3458 -1.1917 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.3917 0.5083 0.0000 H 0 0 0 0 0 0 0 0 0^ 2 5 1 0 0 0^ 3 1 1 0 0 0^ 4 3 1 0 0 0^ 5 1 1 0 0 0^ 6 2 2 0 0 0^ 7 3 1 0 0 0^ 8 2 1 0 0 0^ 9 16 1 0 0 0^ 10 4 1 0 0 0^ 11 10 2 0 0 0^ 12 9 1 0 0 0^ 13 12 2 0 0 0^ 14 1 1 0 0 0^ 15 8 2 0 0 0^ 16 14 1 0 0 0^ 17 6 1 0 0 0^ 18 15 1 0 0 0^ 19 8 1 0 0 0^ 20 11 1 0 0 0^ 21 13 1 0 0 0^ 22 15 1 0 0 0^ 23 19 1 0 0 0^ 24 20 1 0 0 0^ 25 21 1 0 0 0^ 26 22 1 0 0 0^ 3 27 1 6 0 0^ 6 7 1 0 0 0^ 9 4 2 0 0 0^ 13 11 1 0 0 0^ 18 17 2 0 0 0^M END^^
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