Viewing Compound With Structures

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Compound Report Overview

Compound Name: DIOXYBENZONE
Compound Identifier: 704431
Mol Structure 2D: 704431
Molecular Weight: 244
Formula: C14 H12 O4
Development Status: US FDA Approved
SMILES: COc1ccc(C(=O)c2ccccc2O)c(O)c1
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222092D 0 0.00000 0.00000 0^^ 18 19 0 0 0 999 V2000^ -0.6833 1.2958 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.5292 0.5958 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.9083 0.6000 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.7542 1.2833 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.5292 -0.8167 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.9750 0.5833 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.6958 2.6875 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.1208 1.3000 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.9750 -0.8292 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.7542 2.6833 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.7417 -1.5250 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.1083 2.7083 0.0000 O 0 0 0 0 0 0 0 0 0^ -1.9083 -0.8042 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.1875 -1.5167 0.0000 O 0 0 0 0 0 0 0 0 0^ -4.3458 0.6125 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.1875 -2.9125 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.1333 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.3458 -0.8000 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 1 1 0 0 0^ 4 2 1 0 0 0^ 5 2 2 0 0 0^ 6 4 2 0 0 0^ 7 1 2 0 0 0^ 8 3 2 0 0 0^ 9 11 2 0 0 0^ 10 4 1 0 0 0^ 11 5 1 0 0 0^ 12 8 1 0 0 0^ 13 3 1 0 0 0^ 14 9 1 0 0 0^ 15 8 1 0 0 0^ 16 14 1 0 0 0^ 17 13 2 0 0 0^ 18 17 1 0 0 0^ 18 15 2 0 0 0^ 9 6 1 0 0 0^M END^^
Structure View
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