Viewing Compound With Structures

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Compound Report Overview

Compound Name: AMBRUTICIN
Compound Identifier: 705288
Mol Structure 2D: 705288
Molecular Weight: 475
Formula: C28 H42 O6
Development Status: Preclinical
SMILES: CCC1OC(CC=C1C)C(=CC(C)C=CC2C(C)C2C=CC3OC(CC(=O)O)CC(O)C3O)C
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222452D 0 0.00000 0.00000 0^^ 35 37 0 1 0 999 V2000^ -1.4000 0.7208 0.0000 C 0 0 2 0 0 0 0 0 0^ -0.8708 1.0000 0.0000 C 0 0 2 0 0 0 0 0 0^ -0.8750 0.4083 0.0000 C 0 0 1 0 0 0 0 0 0^ -1.9833 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.3333 1.2833 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.7875 1.2458 0.0000 O 0 0 0 0 0 0 0 0 0^ -2.9458 0.2583 0.0000 C 0 0 2 0 0 0 0 0 0^ -3.2458 -0.2542 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.2333 0.8083 0.0000 C 0 0 1 0 0 0 0 0 0^ -2.3458 0.2458 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.7167 1.2333 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.8708 -0.2375 0.0000 C 0 0 2 0 0 0 0 0 0^ 2.2417 0.9500 0.0000 C 0 0 1 0 0 0 0 0 0^ -3.8500 0.8083 0.0000 C 0 0 2 0 0 0 0 0 0^ 3.2875 0.3083 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.1917 0.9458 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.1958 -0.7542 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.7667 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.2875 0.9250 0.0000 C 0 0 1 0 0 0 0 0 0^ -4.1583 0.3000 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.9333 -1.2917 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.1792 0.9625 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.2292 0.3583 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.3250 -1.2792 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.6292 1.3250 0.0000 C 0 0 1 0 0 0 0 0 0^ -2.9083 1.2958 0.0000 O 0 0 0 0 0 0 0 0 0^ -4.1333 1.3583 0.0000 O 0 0 0 0 0 0 0 0 0^ -0.1500 0.2208 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.2708 -1.8000 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.7167 1.8458 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.8042 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.8250 1.2208 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6292 1.9125 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.3417 0.8958 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.0250 -0.2000 0.0000 H 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 1 1 0 0 0^ 1 4 1 6 0 0^ 2 5 1 1 0 0^ 6 13 1 0 0 0^ 7 10 1 6 0 0^ 8 7 1 0 0 0^ 9 7 1 0 0 0^ 10 4 2 0 0 0^ 11 16 2 0 0 0^ 12 8 1 0 0 0^ 13 11 1 6 0 0^ 14 9 1 0 0 0^ 15 18 2 0 0 0^ 16 25 1 0 0 0^ 12 17 1 6 0 0^ 18 23 1 0 0 0^ 19 6 1 0 0 0^ 20 14 1 0 0 0^ 21 17 1 0 0 0^ 22 5 2 0 0 0^ 23 13 1 0 0 0^ 24 21 2 0 0 0^ 25 22 1 0 0 0^ 9 26 1 1 0 0^ 14 27 1 6 0 0^ 3 28 1 1 0 0^ 29 21 1 0 0 0^ 30 11 1 0 0 0^ 31 15 1 0 0 0^ 19 32 1 6 0 0^ 25 33 1 1 0 0^ 34 32 1 0 0 0^ 3 35 1 6 0 0^ 3 2 1 0 0 0^ 20 12 1 0 0 0^ 15 19 1 0 0 0^M END^^
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