Viewing Compound With Structures

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Compound Report Overview

Compound Name: MENABITAN
Compound Identifier: 706878
Mol Structure 2D: 706878
Molecular Weight: 577
Formula: C37 H56 N2 O3
Development Status: Preclinical
SMILES: CCCCCC(C)C(C)c1cc(OC(=O)C(C)CCN2CCCCC2C)c3C4=C(CCN(CC#C)C4)C(C)(C)Oc3c1
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222502D 0 0.00000 0.00000 0^^ 42 45 0 0 0 999 V2000^ -1.6208 0.7083 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.2500 0.3583 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.0000 0.3458 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.0000 -0.3792 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.2500 -0.3792 0.0000 C 0 0 3 0 0 0 0 0 0^ -1.6083 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0^ -0.3750 0.7000 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.2625 -0.4000 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.3792 1.8833 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.3750 1.4250 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.7417 2.4333 0.0000 N 0 0 3 0 0 0 0 0 0^ -0.3583 -0.7542 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.2625 0.3333 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.6083 1.4208 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.2625 1.8083 0.0000 N 0 0 3 0 0 0 0 0 0^ -2.8833 0.7208 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.0458 2.9208 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.9625 3.2583 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.9667 -0.7917 0.0000 C 0 0 3 0 0 0 0 0 0^ 2.2875 2.0333 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.2292 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.7417 3.1250 0.0000 C 0 0 3 0 0 0 0 0 0^ 1.0625 1.7958 0.0000 C 0 0 3 0 0 0 0 0 0^ -2.8708 1.4375 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.7042 2.4125 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.2625 2.6458 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.9917 -0.7792 0.0000 C 0 0 3 0 0 0 0 0 0^ -3.0500 -0.2042 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.5958 -1.0292 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.4250 2.0333 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6792 -1.4542 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.0917 3.5708 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.3042 3.5958 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.2667 1.0583 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.7417 -1.3542 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.3292 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.7167 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.1042 -3.2000 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.1167 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.9542 2.4833 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.4542 -3.5875 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.9542 3.1500 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 1 2 0 0 0^ 3 1 1 0 0 0^ 4 3 2 0 0 0^ 5 2 1 0 0 0^ 6 4 1 0 0 0^ 7 3 1 0 0 0^ 8 13 1 0 0 0^ 9 10 1 0 0 0^ 10 7 1 0 0 0^ 11 20 1 0 0 0^ 12 4 1 0 0 0^ 13 7 2 0 0 0^ 14 1 1 0 0 0^ 15 14 1 0 0 0^ 16 2 1 0 0 0^ 17 26 1 0 0 0^ 18 17 3 0 0 0^ 19 8 1 0 0 0^ 20 25 1 0 0 0^ 21 9 2 0 0 0^ 22 11 1 0 0 0^ 23 9 1 0 0 0^ 24 15 1 0 0 0^ 25 23 1 0 0 0^ 26 15 1 0 0 0^ 27 19 1 0 0 0^ 28 5 1 0 0 0^ 29 5 1 0 0 0^ 30 11 1 0 0 0^ 31 19 1 0 0 0^ 32 22 1 0 0 0^ 33 22 1 0 0 0^ 34 23 1 0 0 0^ 35 27 1 0 0 0^ 36 27 1 0 0 0^ 37 35 1 0 0 0^ 38 39 1 0 0 0^ 39 37 1 0 0 0^ 40 30 1 0 0 0^ 41 38 1 0 0 0^ 42 40 1 0 0 0^ 24 16 1 0 0 0^ 8 12 2 0 0 0^ 6 5 1 0 0 0^ 42 33 1 0 0 0^M END^^
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