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Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
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Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
BioCyc websites down
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for maintenance.
Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
BioCyc websites down
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Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
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Escherichia coli K-12 substr. MG1655 Compound: ethidium

Synonyms: ethidium cation, homidium

Component of: AcrR-ethidium

Chemical Formula: C21H20N3

Molecular Weight: 314.41 Daltons

Monoisotopic Molecular Weight: 314.1657226576 Daltons

SMILES: CC[N+]3(C1(=C(C=CC(N)=C1)C4(C(C(C2(=CC=CC=C2))=3)=CC(N)=CC=4)))

InChI: InChI=1S/C21H19N3/c1-2-24-20-13-16(23)9-11-18(20)17-10-8-15(22)12-19(17)21(24)14-6-4-3-5-7-14/h3-13,23H,2,22H2,1H3/p+1

InChIKey: InChIKey=QTANTQQOYSUMLC-UHFFFAOYSA-O

Unification Links: CAS:3546-21-2 , ChEBI:42478 , ChemSpider:3498 , PubChem:3624

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): 126.31

In Reactions of unknown directionality:

Not in pathways:
AcrR + ethidium = AcrR-ethidium

In Transport reactions:
ethidium[cytosol]ethidium[periplasmic space]

Credits:
Created 04-Sep-2009 by Kothari A , SRI International


Report Errors or Provide Feedback
Please cite the following article in publications resulting from the use of EcoCyc: Nucleic Acids Research 41:D605-12 2013
Page generated by SRI International Pathway Tools version 18.5 on Sat Dec 20, 2014, biocyc12.