MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
Search MNXref
My Selection
Summary
Pick from repository
Import model
Upload reactions
Delete models
Upload genome
Revived!
Analyze
Flux balance (FBA)
Groups of coupled reactions (GCR)
Blocked reactions (BLO)
Reaction knockout (RKO)
Gene/peptide knockout (PKO)
Create / Modify
Combine logically
Split and merge
Growth recovery (GRE)
Build from a genome (BUILD)
Revived!
Utilities
Search/Download MNXref namespace
MNXref ID mapper
SPARQL query
Reset session
Documents
Getting started
A short tutorial
Model internals
About
help [AT] metanetx.org
Info / How to cite
Feedback
7-bromo-5-heptynoic acid
Properties
Image
MNX_ID
MNXM28383
reference
lipidmapsM:LMFA01090030
formula
C
7
H
9
BrO
2
global charge
0
mol weight
205.051
InChIKey
MEPYEDWQGLFULE-UHFFFAOYSA-N
InChI
InChI=1S/C7H9BrO2/c8-6-4-2-1-3-5-7(9)10/h1,3,5-6H2,(H,9,10)
SMILES
O=C(O)CCCC#CCBr
MNX internals
InChI (mnx)
InChI=1/C7H9BrO2/c8-6-4-2-1-3-5-7(9)10/h1,3,5-6H2,(H,9,10)
SMILES (mnx)
[CH2:1]([C:2]#[C:4][CH2:6][Br:8])[CH2:3][CH2:5][C:7](=[O:9])[OH:10]
Parent-child relations graph
Occurences in reactions
#reac
in my sandbox
0
in MNXref (generic)
0
in models (compartimentalized)
0
Similar chemical compounds in external resources
Identifier
Description
lipidmaps:LMFA01090030
lipidmapsM:LMFA01090030
MEPYEDWQGLFULE-UHFFFAOYSA-N
7-bromo-5-heptynoic acid
5-Heptynoic acid, 7-bromo-
7-Bromo-5-heptynoic acid
7-bromo-5-heptynoic acid