Viewing Compound With Structures

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Compound Report Overview

Compound Name: TBC-1269
Compound Identifier: 704131
Mol Structure 2D: 704131
Molecular Weight: 863
Formula: C46 H54 O16
Development Status: Clinical, Phase II/III
SMILES: OCC1OC(Oc2ccc(CCCCCCc3ccc(OC4OC(CO)C(O)C(O)C4O)c(c3)c5cccc(CC(=O)O)c5)cc2c6cccc(CC(=O)O)c6)C(O)C(O)C1O
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100223272D 0 0.00000 0.00000 0^^ 62 67 0 1 0 999 V2000^ 2.4167 1.1833 0.0000 C 0 0 2 0 0 0 0 0 0^ -2.4458 -1.1792 0.0000 C 0 0 2 0 0 0 0 0 0^ 2.0417 1.3958 0.0000 C 0 0 2 0 0 0 0 0 0^ -2.8208 -1.3917 0.0000 C 0 0 2 0 0 0 0 0 0^ 2.0417 1.8458 0.0000 C 0 0 2 0 0 0 0 0 0^ -2.8208 -1.8292 0.0000 C 0 0 2 0 0 0 0 0 0^ 2.7792 1.3833 0.0000 O 0 0 0 0 0 0 0 0 0^ -2.0750 -1.3875 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.4167 2.0458 0.0000 C 0 0 1 0 0 0 0 0 0^ -2.4458 -2.0417 0.0000 C 0 0 1 0 0 0 0 0 0^ 2.7792 1.8458 0.0000 C 0 0 1 0 0 0 0 0 0^ -2.0750 -1.8417 0.0000 C 0 0 1 0 0 0 0 0 0^ 2.0375 0.1083 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.0750 -0.0917 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.4167 0.7458 0.0000 O 0 0 0 0 0 0 0 0 0^ -2.4458 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0^ -2.0750 -0.5375 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.0375 0.5333 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.4458 0.1125 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.4167 -0.0917 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.9458 0.0958 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.9250 -0.0917 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.8083 -0.1042 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.7792 0.1333 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.6542 -0.1167 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.7083 0.1125 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.7083 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.6542 0.7583 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.9250 -0.5167 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.9458 0.5208 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.1833 0.1125 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.1542 -0.0917 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.1958 -1.1792 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.6542 1.2208 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.1833 -2.0542 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.6542 2.0458 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.5750 -0.1042 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.5375 0.1125 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.4167 2.4708 0.0000 O 0 0 0 0 0 0 0 0 0^ -2.4458 -2.4667 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.2875 0.1125 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.3208 -0.0917 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.2792 0.1125 0.0000 O 0 0 0 0 0 0 0 0 0^ -4.3208 -0.1042 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.2875 0.5333 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.3208 -0.5375 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.1542 2.0458 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.6958 -2.0542 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.4458 0.5333 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.4167 -0.5167 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.5167 1.8458 0.0000 O 0 0 0 0 0 0 0 0 0^ -1.3333 -1.8417 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.7792 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.8083 0.7583 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.1542 -0.5167 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.1833 0.5333 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.9167 -0.0917 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.9458 0.1125 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.5833 -0.0917 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.5375 0.1125 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.1667 -0.0917 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.2000 0.1125 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 16 1 1 0 0^ 3 1 1 0 0 0^ 4 2 1 0 0 0^ 5 3 1 0 0 0^ 6 4 1 0 0 0^ 7 1 1 0 0 0^ 8 2 1 0 0 0^ 9 11 1 0 0 0^ 10 12 1 0 0 0^ 11 7 1 0 0 0^ 12 8 1 0 0 0^ 13 18 2 0 0 0^ 14 26 2 0 0 0^ 1 15 1 6 0 0^ 16 17 1 0 0 0^ 17 27 2 0 0 0^ 18 15 1 0 0 0^ 19 14 1 0 0 0^ 20 13 1 0 0 0^ 21 37 1 0 0 0^ 22 38 1 0 0 0^ 23 19 1 0 0 0^ 24 20 2 0 0 0^ 25 13 1 0 0 0^ 26 42 1 0 0 0^ 27 46 1 0 0 0^ 28 18 1 0 0 0^ 29 22 2 0 0 0^ 30 21 2 0 0 0^ 31 23 2 0 0 0^ 32 24 1 0 0 0^ 4 33 1 6 0 0^ 3 34 1 1 0 0^ 6 35 1 6 0 0^ 5 36 1 1 0 0^ 37 31 1 0 0 0^ 38 32 1 0 0 0^ 9 39 1 6 0 0^ 10 40 1 1 0 0^ 41 45 1 0 0 0^ 42 58 1 0 0 0^ 43 22 1 0 0 0^ 44 21 1 0 0 0^ 45 28 2 0 0 0^ 46 42 2 0 0 0^ 11 47 1 1 0 0^ 12 48 1 6 0 0^ 49 19 2 0 0 0^ 50 20 1 0 0 0^ 51 47 1 0 0 0^ 52 48 1 0 0 0^ 53 50 2 0 0 0^ 54 49 1 0 0 0^ 55 53 1 0 0 0^ 56 54 2 0 0 0^ 57 41 1 0 0 0^ 58 59 1 0 0 0^ 59 62 1 0 0 0^ 60 57 1 0 0 0^ 61 60 1 0 0 0^ 62 61 1 0 0 0^ 9 5 1 0 0 0^ 41 25 2 0 0 0^ 55 32 2 0 0 0^ 17 14 1 0 0 0^ 56 31 1 0 0 0^ 10 6 1 0 0 0^M END^^
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