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CHEBI:230571 - 3'-n-acetyl-4'-o-(14-methylheptadecanoyl)fusarochromanone

Default Structure
ChEBI IDCHEBI:230571
ChEBI Name3'-n-acetyl-4'-o-(14-methylheptadecanoyl)fusarochromanone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H56N2O6
Net Charge0
Average Mass600.841
Monoisotopic Mass600.41384
SMILESCC(=O)NC(COC(=O)CCCCCCCCCCCCCCC(C)C)CC(=O)c1ccc2c(c1N)C(=O)CC(C)(C)O2
InChIInChI=1S/C35H56N2O6/c1-25(2)18-16-14-12-10-8-6-7-9-11-13-15-17-19-32(41)42-24-27(37-26(3)38)22-29(39)28-20-21-31-33(34(28)36)30(40)23-35(4,5)43-31/h20-21,25,27H,6-19,22-24,36H2,1-5H3,(H,37,38)
InChIKeyNQLASHIWANSPGZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
3'-n-acetyl-4'-o-(14-methylheptadecanoyl)fusarochromanone (CHEBI:230571) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
[2-acetamido-4-(5-amino-2,2-dimethyl-4-oxo-3H-chromen-6-yl)-4-oxobutyl] 16-methylheptadecanoate
Manual XrefsDatabases
35014603ChemSpider
HMDB0038565HMDB