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CHEBI:220337 - Phomolide H

ChEBI IDCHEBI:220337
ChEBI NamePhomolide H
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H22O5
Net Charge0
Average Mass258.314
Monoisotopic Mass258.14672
SMILESCCC[C@@H]1C[C@H](O)[C@@H](O)/C=C/[C@@H](OC)CC(=O)O1
InChIInChI=1S/C13H22O5/c1-3-4-10-7-12(15)11(14)6-5-9(17-2)8-13(16)18-10/h5-6,9-12,14-15H,3-4,7-8H2,1-2H3/b6-5+/t9-,10-,11+,12+/m1/s1
InChIKeyTZYNNKFLVAMHEW-RNKUOQLFSA-N
Species of MetaboliteComponentSourceComments
Phomopsisspecies A123 (ncbitaxon:559193) - PubMed (26281194)
ChEBI Ontology
Outgoing Relation(s)
Phomolide H (CHEBI:220337) is a oxacycle (CHEBI:38104)
IUPAC Name 
(2R,4S,5S,6E,8S)-4,5-dihydroxy-8-methoxy-2-propyl-2,3,4,5,8,9-hexahydrooxecin-10-one
Manual XrefsDatabases
29215170ChemSpider