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Compound Report Overview

Compound Name: FUMOXICILLIN
Compound Identifier: 705404
Mol Structure 2D: 705404
Molecular Weight: 443
Formula: C21 H21 N3 O6 S
Development Status: Preclinical
SMILES: CC1(C)SC2C(NC(=O)C(N=Cc3ccco3)c4ccc(O)cc4)C(=O)N2C1C(=O)O
Compound Structures
>^ ISISHOST06100222492D 0 0.00000 0.00000 0^^ 35 38 0 1 0 999 V2000^ 6.3417 -3.1875 0.0000 N 0 0 3 0 0 0 0 0 0^ 6.3417 -2.3875 0.0000 C 0 0 1 0 0 0 0 0 0^ 5.5292 -3.1917 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.5292 -2.3792 0.0000 C 0 0 1 0 0 0 0 0 0^ 7.1042 -3.4417 0.0000 C 0 0 2 0 0 0 0 0 0^ 7.1125 -2.1250 0.0000 S 0 0 0 0 0 0 0 0 0^ 7.5917 -2.7792 0.0000 C 0 0 3 0 0 0 0 0 0^ 4.7000 -2.3875 0.0000 N 0 0 0 0 0 0 0 0 0^ 4.1625 -2.8917 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.6042 -1.7667 0.0000 N 0 0 0 0 0 0 0 0 0^ 7.7667 -3.9292 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.3250 -2.7042 0.0000 C 0 0 2 0 0 0 0 0 0^ 4.9500 -3.7792 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.0917 -0.2667 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.9042 -1.0542 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.8167 0.0750 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.5917 -2.3417 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.2917 -3.7417 0.0000 O 0 0 0 0 0 0 0 0 0^ 7.6792 -4.7417 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.5292 0.2958 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.6875 0.8958 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.9000 0.9958 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.9917 -2.9417 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.3792 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.5167 -3.6125 0.0000 O 0 0 0 0 0 0 0 0 0^ 8.3042 -3.1917 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.2542 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.0042 -1.9125 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.2042 -2.7125 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.5792 -1.3375 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.2000 -1.6917 0.0000 O 0 0 0 0 0 0 0 0 0^ 6.3417 -1.5625 0.0000 H 0 0 0 0 0 0 0 0 0^ 6.6167 -4.1042 0.0000 H 0 0 0 0 0 0 0 0 0^ 5.3917 -1.5875 0.0000 H 0 0 0 0 0 0 0 0 0^ 3.1000 -3.5042 0.0000 H 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 1 1 0 0 0^ 4 3 1 0 0 0^ 5 1 1 0 0 0^ 6 2 1 0 0 0^ 7 5 1 0 0 0^ 4 8 1 1 0 0^ 9 8 1 0 0 0^ 12 10 1 6 0 0^ 5 11 1 6 0 0^ 12 9 1 0 0 0^ 13 3 2 0 0 0^ 14 15 1 0 0 0^ 15 10 2 0 0 0^ 16 14 1 0 0 0^ 17 12 1 0 0 0^ 18 9 2 0 0 0^ 19 11 2 0 0 0^ 20 14 2 0 0 0^ 21 16 1 0 0 0^ 22 20 1 0 0 0^ 23 17 2 0 0 0^ 24 17 1 0 0 0^ 25 11 1 0 0 0^ 26 7 1 0 0 0^ 27 7 1 0 0 0^ 28 30 1 0 0 0^ 29 23 1 0 0 0^ 30 24 2 0 0 0^ 31 28 1 0 0 0^ 2 32 1 6 0 0^ 5 33 1 1 0 0^ 4 34 1 6 0 0^ 12 35 1 6 0 0^ 7 6 1 0 0 0^ 4 2 1 0 0 0^ 28 29 2 0 0 0^ 21 22 2 0 0 0^M END^^
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