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CHEBI:225659 - 3-deoxyaureosurfactin

ChEBI IDCHEBI:225659
ChEBI Name3-deoxyaureosurfactin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H40O6
Net Charge0
Average Mass388.545
Monoisotopic Mass388.28249
SMILESCCCCC[C@@H](O)C[C@@H](O)CC(=O)O[C@H](CCCCC)CCCC(=O)OC
InChIInChI=1S/C21H40O6/c1-4-6-8-11-17(22)15-18(23)16-21(25)27-19(12-9-7-5-2)13-10-14-20(24)26-3/h17-19,22-23H,4-16H2,1-3H3/t17-,18-,19-/m1/s1
InChIKeyNZRUDJPSBIXCFY-GUDVDZBRSA-N
Species of MetaboliteComponentSourceComments
Aureobasidium (ncbitaxon:5579) - PubMed (26758494)
ChEBI Ontology
Outgoing Relation(s)
3-deoxyaureosurfactin (CHEBI:225659) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
[(5R)-1-methoxy-1-oxodecan-5-yl] (3R,5R)-3,5-dihydroxydecanoate
Manual XrefsDatabases
78441579ChemSpider