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CHEBI:206892 - Skeletocutin B

ChEBI IDCHEBI:206892
ChEBI NameSkeletocutin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC27H38O8
Net Charge0
Average Mass490.593
Monoisotopic Mass490.25667
SMILESCC1=C(CCCCCCCCCCCCCCCCC2=C(C(=O)O)CC(=O)OC2=O)C(=O)OC1=O
InChIInChI=1S/C27H38O8/c1-19-20(26(32)35-25(19)31)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-21-22(24(29)30)18-23(28)34-27(21)33/h2-18H2,1H3,(H,29,30)
InChIKeyTXQAPNSBRYVSJA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Skeletocutisspecies (ncbitaxon:2028179) - PubMed (31310114)
ChEBI Ontology
Outgoing Relation(s)
Skeletocutin B (CHEBI:206892) has functional parent hexacarboxylic acid (CHEBI:59359)
Skeletocutin B (CHEBI:206892) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
5-[16-(4-methyl-2,5-dioxouran-3-yl)hexadecyl]-2,6-dioxo-3H-pyran-4-carboxylic acid