Viewing Compound With Structures

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Gene Compound Experiment Study Pathway Assay Report Bug Request Feature

Compound Report Overview

Compound Name: SP/W-5186
Compound Identifier: 704171
Mol Structure 2D: 704171
Molecular Weight: 393
Formula: C14 H23 N3 O8 S
Development Status: Clinical, Phase I
SMILES: CCOC(=O)C(CSC(=O)CNC(=O)C)NC(=O)C(C)(C)CO[N+](=O)[O-]
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100223272D 0 0.00000 0.00000 0^^ 26 25 0 1 0 999 V2000^ -4.0000 -0.5667 0.0000 N 0 3 0 0 0 0 0 0 0^ -1.1333 -0.5792 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.8625 -0.9917 0.0000 C 0 0 3 0 0 0 0 0 0^ 0.3125 -0.5792 0.0000 C 0 0 2 0 0 0 0 0 0^ -0.4083 -0.9917 0.0000 N 0 0 0 0 0 0 0 0 0^ 1.0167 -0.9917 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.0000 0.2583 0.0000 O 0 5 0 0 0 0 0 0 0^ 1.0042 1.4750 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.2875 -0.9917 0.0000 O 0 0 0 0 0 0 0 0 0^ -4.7208 -0.9667 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.1542 1.8958 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.5708 -0.5792 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.0042 0.6500 0.0000 S 0 0 0 0 0 0 0 0 0^ 0.3125 0.2458 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.1333 0.2458 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.4375 1.4750 0.0000 N 0 0 0 0 0 0 0 0 0^ 1.0167 -1.8042 0.0000 O 0 0 0 0 0 0 0 0 0^ 0.3125 1.8958 0.0000 O 0 0 0 0 0 0 0 0 0^ 3.1542 2.7125 0.0000 O 0 0 0 0 0 0 0 0 0^ 1.7292 1.8958 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.7500 -0.5792 0.0000 O 0 0 0 0 0 0 0 0 0^ -1.1958 -1.4667 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.5250 -1.4667 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.8667 1.4750 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.4667 -0.9917 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.1792 -0.5792 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 3 1 0 0 0^ 3 12 1 0 0 0^ 4 5 1 0 0 0^ 5 2 1 0 0 0^ 6 4 1 0 0 0^ 7 1 1 0 0 0^ 8 13 1 0 0 0^ 9 1 1 0 0 0^ 10 1 2 0 0 0^ 11 16 1 0 0 0^ 12 9 1 0 0 0^ 13 14 1 0 0 0^ 4 14 1 1 0 0^ 15 2 2 0 0 0^ 16 20 1 0 0 0^ 17 6 2 0 0 0^ 18 8 2 0 0 0^ 19 11 2 0 0 0^ 20 8 1 0 0 0^ 21 6 1 0 0 0^ 22 3 1 0 0 0^ 23 3 1 0 0 0^ 24 11 1 0 0 0^ 25 21 1 0 0 0^ 26 25 1 0 0 0^M CHG 2 1 1 7 -1^M END^^
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