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CHEBI:226109 - 15,16-dihydrosacrolide A

ChEBI IDCHEBI:226109
ChEBI Name15,16-dihydrosacrolide A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H30O4
Net Charge0
Average Mass310.434
Monoisotopic Mass310.21441
SMILESCCCCC[C@H]1OC(=O)CCCCCCC[C@@H](O)/C=C/C1=O
InChIInChI=1S/C18H30O4/c1-2-3-7-11-17-16(20)14-13-15(19)10-8-5-4-6-9-12-18(21)22-17/h13-15,17,19H,2-12H2,1H3/b14-13+/t15-,17-/m1/s1
InChIKeyJJQOCZNUTZIGAX-RCKIBTJTSA-N
Species of MetaboliteComponentSourceComments
Aphanothece sacrum (ncbitaxon:1122) - PubMed (28270686)
ChEBI Ontology
Outgoing Relation(s)
15,16-dihydrosacrolide A (CHEBI:226109) is a macrolide (CHEBI:25106)
IUPAC Name 
(10R,11E,14R)-10-hydroxy-14-pentyl-1-oxacyclotetradec-11-ene-2,13-dione
Manual XrefsDatabases
78438808ChemSpider