Viewing Compound With Structures

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Compound Report Overview

Compound Name: ERLOTINIB
Compound Identifier: 704146
Mol Structure 2D: 704146
Molecular Weight: 393
Formula: C22 H23 N3 O4
Development Status: US FDA Approved, launched Nov. 2004
SMILES: COCCOc1cc2ncnc(Nc3cccc(C#C)c3)c2cc1OCCOC
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100223272D 0 0.00000 0.00000 0^^ 29 31 0 0 0 999 V2000^ 4.5625 -3.6667 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.2750 -3.2667 0.0000 C 0 0 0 0 0 0 0 0 0^ 4.5542 -4.4917 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.8542 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.9875 -3.6792 0.0000 N 0 0 0 0 0 0 0 0 0^ 3.8292 -4.9000 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.2792 -2.4417 0.0000 N 0 0 0 0 0 0 0 0 0^ 3.1375 -3.6417 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.1250 -4.4750 0.0000 C 0 0 0 0 0 0 0 0 0^ 8.1500 -2.4292 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.2542 -4.9167 0.0000 N 0 0 0 0 0 0 0 0 0^ 8.8667 -2.8417 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.9792 -4.5167 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.0042 -2.0292 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.4292 -2.0167 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.7167 -2.4417 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.4250 -3.2250 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.4042 -4.8750 0.0000 O 0 0 0 0 0 0 0 0 0^ 6.7042 -0.7875 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.2667 -4.4292 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.2750 -3.6042 0.0000 O 0 0 0 0 0 0 0 0 0^ 5.9917 -1.2042 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.4292 -1.1917 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.7000 -4.4542 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.7042 -3.6292 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.9792 -4.8542 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.9917 -3.2000 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.4333 -3.1792 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.4583 -4.8417 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 1 2 0 0 0^ 5 2 2 0 0 0^ 6 3 2 0 0 0^ 7 2 1 0 0 0^ 8 4 1 0 0 0^ 9 8 2 0 0 0^ 10 15 1 0 0 0^ 11 3 1 0 0 0^ 12 10 3 0 0 0^ 13 11 2 0 0 0^ 14 7 1 0 0 0^ 15 16 1 0 0 0^ 16 14 2 0 0 0^ 17 8 1 0 0 0^ 18 9 1 0 0 0^ 19 22 2 0 0 0^ 20 26 1 0 0 0^ 21 27 1 0 0 0^ 22 14 1 0 0 0^ 23 19 1 0 0 0^ 24 18 1 0 0 0^ 25 17 1 0 0 0^ 26 24 1 0 0 0^ 27 25 1 0 0 0^ 28 21 1 0 0 0^ 29 20 1 0 0 0^ 6 9 1 0 0 0^ 5 13 1 0 0 0^ 15 23 2 0 0 0^M END^^
Structure View
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