CHEBI:132293 - 2-methylicosane

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ChEBI Name 2-methylicosane
ChEBI ID CHEBI:132293
Definition A branched alkane consisting of icosane bearing a single methyl substituent at position 2.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C21H44
Net Charge 0
Average Mass 296.575
Monoisotopic Mass 296.34430
InChI InChI=1S/C21H44/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2)3/h21H,4-20H2,1-3H3
InChIKey MLKZKPUBHSWMNA-UHFFFAOYSA-N
SMILES CCCCCCCCCCCCCCCCCCC(C)C
Metabolite of Species Details
Pseudomonas putida DOT-T1E (NCBI:txid1196325) See: MetaboLights Study
ChEBI Ontology
Outgoing 2-methylicosane (CHEBI:132293) is a alkane (CHEBI:18310)
IUPAC Name
2-methylicosane
Synonyms Sources
2-methyleicosane ChEBI
Isoheneicosane ChemIDplus
isohenicosane ChEBI
Manual Xref Database
452834 ChemSpider
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Registry Numbers Types Sources
1748513 Reaxys Registry Number Reaxys
52845-08-6 CAS Registry Number ChemIDplus
Last Modified
12 January 2017