Viewing Compound With Structures

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Compound Report Overview

Compound Name: DOXOFYLLINE
Compound Identifier: 705731
Mol Structure 2D: 705731
Molecular Weight: 266
Formula: C11 H14 N4 O4
Development Status: Launched outside US, not listed by FDA
SMILES: Cn1c(=O)n(C)c2ncn(CC3OCCO3)c2c1=O
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100223052D 0 0.00000 0.00000 0^^ 19 21 0 0 0 999 V2000^ -0.7250 -1.3417 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.7250 -0.0167 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.8500 -1.9667 0.0000 N 0 0 3 0 0 0 0 0 0^ -2.9750 -0.0167 0.0000 N 0 0 3 0 0 0 0 0 0^ -2.9750 -1.3417 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.8500 0.6083 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.5167 -1.7167 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.5167 0.3583 0.0000 N 0 0 3 0 0 0 0 0 0^ 1.2625 -0.6375 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.9292 1.6458 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.0958 -2.0125 0.0000 O 0 0 0 0 0 0 0 0 0^ -1.8500 1.9375 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.2167 1.8958 0.0000 C 0 0 3 0 0 0 0 0 0^ 3.3000 1.1458 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.6375 3.1083 0.0000 O 0 0 0 0 0 0 0 0 0^ -1.8500 -3.3000 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.0958 0.6458 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.3375 1.9375 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.9250 3.1083 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 5 1 0 0 0^ 5 3 1 0 0 0^ 6 2 1 0 0 0^ 7 1 1 0 0 0^ 8 2 1 0 0 0^ 9 7 2 0 0 0^ 10 8 1 0 0 0^ 11 5 2 0 0 0^ 12 6 2 0 0 0^ 13 10 1 0 0 0^ 14 13 1 0 0 0^ 15 13 1 0 0 0^ 16 3 1 0 0 0^ 17 4 1 0 0 0^ 18 14 1 0 0 0^ 19 15 1 0 0 0^ 9 8 1 0 0 0^ 4 6 1 0 0 0^ 19 18 1 0 0 0^M END^^
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