Viewing Compound With Structures

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Compound Report Overview

Compound Name: LAGATIDE
Compound Identifier: 706258
Mol Structure 2D: 706258
Molecular Weight: 739
Formula: C33 H58 N10 O9
Development Status: Clinical, Phase II/III
SMILES: CC(C)C(NC(=O)C1CCCN1)C(=O)NC(C(C)O)C(=O)NC(CCCCN)C(=O)N2CCCC2C(=O)NC(CCC(=O)N)C(=O)NC(C)C(=O)N
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100223252D 0 0.00000 0.00000 0^^ 53 54 0 1 0 999 V2000^ 0.6167 -0.1167 0.0000 N 0 0 3 0 0 0 0 0 0^ 0.2375 0.1333 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.3708 0.1333 0.0000 C 0 0 1 0 0 0 0 0 0^ -0.9583 -0.1125 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.7625 -0.1125 0.0000 N 0 0 0 0 0 0 0 0 0^ -2.1625 0.1208 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.4542 0.1208 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.9708 0.1208 0.0000 N 0 0 0 0 0 0 0 0 0^ 1.0917 -0.1167 0.0000 C 0 0 2 0 0 0 0 0 0^ -3.3708 -0.1167 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.6667 -0.1375 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.5583 0.1333 0.0000 N 0 0 0 0 0 0 0 0 0^ 1.8542 -0.1375 0.0000 N 0 0 0 0 0 0 0 0 0^ -2.5625 -0.1167 0.0000 C 0 0 1 0 0 0 0 0 0^ 3.0792 0.1208 0.0000 N 0 0 0 0 0 0 0 0 0^ -0.1583 -0.1125 0.0000 C 0 0 1 0 0 0 0 0 0^ 3.8875 0.1333 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.2542 0.1208 0.0000 C 0 0 1 0 0 0 0 0 0^ 3.4792 -0.1500 0.0000 C 0 0 1 0 0 0 0 0 0^ 2.6625 1.3083 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.2250 0.1083 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.2375 0.5958 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.7625 0.1083 0.0000 C 0 0 1 0 0 0 0 0 0^ -0.9583 -0.5792 0.0000 O 0 0 0 0 0 0 0 0 0^ -2.1625 0.5750 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.4542 0.5833 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.3708 -0.5792 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.6667 -0.5917 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.8875 0.5958 0.0000 O 0 0 0 0 0 0 0 0 0^ -1.3708 0.6833 0.0000 C 0 0 2 0 0 0 0 0 0^ 2.2417 1.5333 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.2667 0.6250 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.2875 -0.1167 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.4792 -0.5542 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.5625 -0.7167 0.0000 C 0 0 3 0 0 0 0 0 0^ 2.6625 0.8625 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.0500 1.5583 0.0000 N 0 0 0 0 0 0 0 0 0^ 1.0375 -1.3167 0.0000 N 0 0 0 0 0 0 0 0 0^ 1.2375 -0.5792 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.7625 0.9083 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.8542 -0.8417 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.1583 -0.6125 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.3708 0.5625 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.4792 -0.6125 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.6208 0.5625 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6292 -1.5500 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.9958 0.9083 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.1833 -0.9375 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.9500 -0.9375 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.2292 -0.8417 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.2292 -1.3167 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.9958 0.8333 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.9708 0.4000 0.0000 H 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 4 1 0 0 0^ 4 12 1 0 0 0^ 5 3 1 0 0 0^ 6 5 1 0 0 0^ 9 7 1 6 0 0^ 8 14 1 0 0 0^ 9 1 1 0 0 0^ 10 8 1 0 0 0^ 11 18 1 0 0 0^ 12 16 1 0 0 0^ 13 7 1 0 0 0^ 14 6 1 0 0 0^ 15 11 1 0 0 0^ 16 2 1 0 0 0^ 17 19 1 0 0 0^ 18 13 1 0 0 0^ 19 15 1 0 0 0^ 20 36 1 0 0 0^ 21 23 1 0 0 0^ 22 2 2 0 0 0^ 23 10 1 1 0 0^ 24 4 2 0 0 0^ 25 6 2 0 0 0^ 26 7 2 0 0 0^ 27 10 2 0 0 0^ 28 11 2 0 0 0^ 29 17 2 0 0 0^ 30 3 1 0 0 0^ 31 20 2 0 0 0^ 18 32 1 1 0 0^ 33 17 1 0 0 0^ 34 1 1 0 0 0^ 14 35 1 6 0 0^ 36 32 1 0 0 0^ 37 20 1 0 0 0^ 38 46 1 0 0 0^ 39 9 1 0 0 0^ 30 40 1 6 0 0^ 41 34 1 0 0 0^ 16 42 1 6 0 0^ 43 21 1 0 0 0^ 19 44 1 1 0 0^ 45 23 1 0 0 0^ 46 51 1 0 0 0^ 47 30 1 0 0 0^ 48 35 1 0 0 0^ 49 35 1 0 0 0^ 50 42 1 0 0 0^ 51 50 1 0 0 0^ 52 45 1 0 0 0^ 3 53 1 6 0 0^ 41 39 1 0 0 0^ 43 52 1 0 0 0^M END^^
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