Viewing Compound With Structures

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Gene Compound Experiment Study Pathway Assay Report Bug Request Feature

Compound Report Overview

Compound Name: K-MAP
Compound Identifier: 702881
Mol Structure 2D: 702881
Molecular Weight: 299
Formula: C13 H17 N O7
Development Status: Clinical, Phase II/III
SMILES: OCC1OC(Nc2ccc(cc2)C(=O)O)C(O)C(O)C1O
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100223072D 0 0.00000 0.00000 0^^ 21 22 0 1 0 999 V2000^ 3.5875 -3.5042 0.0000 C 0 0 2 0 0 0 0 0 0^ 2.9792 -4.1292 0.0000 C 0 0 2 0 0 0 0 0 0^ 2.0042 -4.1292 0.0000 C 0 0 2 0 0 0 0 0 0^ 2.9792 -2.8292 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.3417 -3.5167 0.0000 C 0 0 1 0 0 0 0 0 0^ 1.9917 -2.8292 0.0000 C 0 0 1 0 0 0 0 0 0^ 4.3500 -3.5042 0.0000 N 0 0 0 0 0 0 0 0 0^ 7.2417 -1.7250 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.5250 -2.1542 0.0000 C 0 0 0 0 0 0 0 0 0^ 7.2417 -0.8625 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.1792 -4.8667 0.0000 O 0 0 0 0 0 0 0 0 0^ 5.0500 -2.9792 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.5750 -4.7375 0.0000 O 0 0 0 0 0 0 0 0 0^ 5.8042 -1.7125 0.0000 C 0 0 0 0 0 0 0 0 0^ 6.5250 -2.9792 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.6542 -3.5292 0.0000 O 0 0 0 0 0 0 0 0 0^ 8.0000 -2.1542 0.0000 O 0 0 0 0 0 0 0 0 0^ 5.8042 -3.3792 0.0000 C 0 0 0 0 0 0 0 0 0^ 5.0500 -2.1542 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.6125 -2.3542 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.0625 -2.1542 0.0000 O 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 2 1 0 0 0^ 4 1 1 0 0 0^ 5 6 1 0 0 0^ 6 4 1 0 0 0^ 1 7 1 6 0 0^ 8 9 1 0 0 0^ 9 14 1 0 0 0^ 10 8 2 0 0 0^ 2 11 1 1 0 0^ 12 7 1 0 0 0^ 3 13 1 1 0 0^ 14 19 2 0 0 0^ 15 18 1 0 0 0^ 5 16 1 6 0 0^ 17 8 1 0 0 0^ 18 12 2 0 0 0^ 19 12 1 0 0 0^ 6 20 1 1 0 0^ 21 20 1 0 0 0^ 5 3 1 0 0 0^ 9 15 2 0 0 0^M END^^
Structure View
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