Viewing Compound With Structures

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Gene Compound Experiment Study Pathway Assay Report Bug Request Feature

Compound Report Overview

Compound Name: DEOXYSPERGUALIN
Compound Identifier: 702320
Mol Structure 2D: 702320
Molecular Weight: 388
Formula: C17 H37 N7 O3
Development Status: Preclinical
SMILES: NCCCNCCCCNC(=O)C(O)NC(=O)CCCCCCNC(=N)N
Activities CAS Curations Identifiers Literature Properties Similarities SMILES Structures Synonyms Targets
Compound Structures
>^ ISISHOST06100222522D 0 0.00000 0.00000 0^^ 27 26 0 1 0 999 V2000^ -0.3833 -0.1167 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.0125 0.1583 0.0000 C 0 0 2 0 0 0 0 0 0^ -3.8958 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0^ 0.4000 -0.1167 0.0000 C 0 0 0 0 0 0 0 0 0^ -0.7708 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0^ -4.2833 -0.1167 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.4000 -0.6000 0.0000 O 0 0 0 0 0 0 0 0 0^ -0.7708 0.6333 0.0000 O 0 0 0 0 0 0 0 0 0^ -3.5083 -0.1167 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.7917 0.1583 0.0000 N 0 0 0 0 0 0 0 0 0^ -3.8958 0.6333 0.0000 N 0 0 0 0 0 0 0 0 0^ 0.0125 0.6333 0.0000 O 0 0 0 0 0 0 0 0 0^ 2.7417 -0.1167 0.0000 N 0 0 0 0 0 0 0 0 0^ 4.3042 -0.1167 0.0000 N 0 0 0 0 0 0 0 0 0^ 3.5250 -0.1167 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.1625 -0.1167 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.1375 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0^ 3.9167 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0^ -3.1125 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.1792 -0.1167 0.0000 C 0 0 0 0 0 0 0 0 0^ 2.3542 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.5583 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.7250 -0.1167 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.5750 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0^ 1.9625 -0.1167 0.0000 C 0 0 0 0 0 0 0 0 0^ -2.3333 0.1583 0.0000 C 0 0 0 0 0 0 0 0 0^ -1.9458 -0.1167 0.0000 C 0 0 0 0 0 0 0 0 0^ 2 1 1 0 0 0^ 3 9 1 0 0 0^ 4 2 1 0 0 0^ 5 1 1 0 0 0^ 6 3 2 0 0 0^ 7 4 2 0 0 0^ 8 5 2 0 0 0^ 9 19 1 0 0 0^ 10 4 1 0 0 0^ 11 3 1 0 0 0^ 2 12 1 1 0 0^ 13 21 1 0 0 0^ 14 18 1 0 0 0^ 15 17 1 0 0 0^ 16 5 1 0 0 0^ 17 13 1 0 0 0^ 18 15 1 0 0 0^ 19 23 1 0 0 0^ 20 10 1 0 0 0^ 21 25 1 0 0 0^ 22 16 1 0 0 0^ 23 26 1 0 0 0^ 24 20 1 0 0 0^ 25 24 1 0 0 0^ 26 27 1 0 0 0^ 27 22 1 0 0 0^M END^^
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