MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
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The Swiss Initiative in Systems Biology
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Summary
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Upload reactions
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Flux balance (FBA)
Groups of coupled reactions (GCR)
Blocked reactions (BLO)
Reaction knockout (RKO)
Gene/peptide knockout (PKO)
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A short tutorial
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aurachin RE
Properties
Image
Occurences in reactions
MNX_ID
MNXM148955
#reac
in my sandbox
0
in MNXref (generic)
1
in models (compartimentalized)
0
formula
C
25
H
33
NO
3
charge
0
mass
395.24604
reference
metacycM:CPD-15906
InChIKey
CHMBGHGLJJOOSO-VAKGXLRMSA-N
InChI
InChI=1S/C25H33NO3/c1-17(2)15-21(27)16-19(4)10-8-9-18(3)13-14-22-20(5)26(29)24-12-7-6-11-23(24)25(22)28/h6-7,10-13,15,21,27,29H,8-9,14,16H2,1-5H3/b18-13+,19-10+
SMILES
CC(C)=CC(O)C/C(C)=C/CC/C(C)=C/Cc1c(C)n(O)c2ccccc2c1=O
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
Identifier
Description
metacyc.compound:CPD-15906
metacycM:CPD-15906
seed.compound:cpd35383
seedM:cpd35383
aurachin RE
seedM:M_cpd35383
secondary/obsolete/fantasy identifier