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CHEBI:132929 - methyl 6-(pentacyclo[6.4.0.02,7.03,6.09,12]dodec-4-yl)hexanoate

ChEBI IDCHEBI:132929
ChEBI Namemethyl 6-(pentacyclo[6.4.0.02,7.03,6.09,12]dodec-4-yl)hexanoate
Stars
ASCII Namemethyl 6-(pentacyclo[6.4.0.0(2,7).0(3,6).0(9,12)]dodec-4-yl)hexanoate
DefinitionA fatty acid methyl ester consisting of methyl hexanoate, which is terminally substituted by five fused butane-rings ([5]-ladderane). Ladderane fatty acid methyl esters are core lipids of anammox bacteria.
Last Modified7 November 2016
Submittermbuss
DownloadsMolfile
FormulaC19H28O2
Net Charge0
Average Mass288.431
Monoisotopic Mass288.20893
SMILESCOC(=O)CCCCCC1CC2C1C1C3C4CCC4C3C21
InChIInChI=1S/C19H28O2/c1-21-14(20)6-4-2-3-5-10-9-13-15(10)19-17-12-8-7-11(12)16(17)18(13)19/h10-13,15-19H,2-9H2,1H3
InChIKeyIGEXBKXEUAAQCD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
methyl 6-(pentacyclo[6.4.0.02,7.03,6.09,12]dodec-4-yl)hexanoate (CHEBI:132929) has functional parent methyl hexanoate (CHEBI:77322)
methyl 6-(pentacyclo[6.4.0.02,7.03,6.09,12]dodec-4-yl)hexanoate (CHEBI:132929) is a fatty acid methyl ester (CHEBI:4986)
methyl 6-(pentacyclo[6.4.0.02,7.03,6.09,12]dodec-4-yl)hexanoate (CHEBI:132929) is a ladderane (CHEBI:85034)
IUPAC Name 
methyl 6-(pentacyclo[6.4.0.02,7.03,6.09,12]dodec-4-yl)hexanoate
Synonyms  Source
C18[5]-FAMESUBMITTER
C18-[5]-ladderane fatty acid methyl esterChEBI
Manual XrefsDatabases
102256095PubChem Compound